molvision/ESOL-V-SMILES-0 · Datasets at Hugging Face

Question stringlengths 471 531	Answer stringlengths 19 34	TargetMolecule stringlengths 2 62	SampleMethod stringclasses 1 value	SampleRep stringclasses 1 value
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1[nH]c(=O)n(c(=O)c1Cl)C(C)(C)C Log Solubility:	<float>-2.484</float>	Cc1[nH]c(=O)n(c(=O)c1Cl)C(C)(C)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOP(=S)(OCC)SCCSCC Log Solubility:	<float>-4.23</float>	CCOP(=S)(OCC)SCCSCC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN2c1cc(N(C)C)cc(C)c1NC(=O)c3cccnc23 Log Solubility:	<float>-4.871</float>	CCN2c1cc(N(C)C)cc(C)c1NC(=O)c3cccnc23	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccc(C)cc1O Log Solubility:	<float>-2.22</float>	CC(C)c1ccc(C)cc1O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2 Log Solubility:	<float>-6.02</float>	Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)C(Cl)(Cl)Cl Log Solubility:	<float>-2.6</float>	ClC(Cl)C(Cl)(Cl)Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2 Log Solubility:	<float>-6.9</float>	ClC(Cl)=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C1c2ccccc2c3ccc4ccccc4c13 Log Solubility:	<float>-6.68</float>	C1c2ccccc2c3ccc4ccccc4c13	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl Log Solubility:	<float>-2.63</float>	NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC(O)CC Log Solubility:	<float>-0.8</float>	CCCC(O)CC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCC(=O)C Log Solubility:	<float>-0.8</float>	CCCCC(=O)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(O)cc1 Log Solubility:	<float>-0.17</float>	Oc1ccc(O)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1cccc(N=CN(C)C)c1 Log Solubility:	<float>-2.34</float>	CNC(=O)Oc1cccc(N=CN(C)C)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC=O Log Solubility:	<float>0.58</float>	CCC=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOC(=O)c1ccc(N)cc1 Log Solubility:	<float>-2.616</float>	CCOC(=O)c1ccc(N)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl Log Solubility:	<float>-2.63</float>	NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cc(cc(N(=O)=O)c1O)N(=O)=O Log Solubility:	<float>-1.456</float>	Cc1cc(cc(N(=O)=O)c1O)N(=O)=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNc1nc(Cl)nc(NC(C)C)n1 Log Solubility:	<float>-3.85</float>	CCNc1nc(Cl)nc(NC(C)C)n1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cn1cnc2n(C)c(=O)n(C)c(=O)c12 Log Solubility:	<float>-0.8759999999999999</float>	Cn1cnc2n(C)c(=O)n(C)c(=O)c12	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Sc1nccc(=O)[nH]1 Log Solubility:	<float>-2.273</float>	Sc1nccc(=O)[nH]1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Sc2nc1ccccc1s2 Log Solubility:	<float>-3.18</float>	Sc2nc1ccccc1s2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN2c1ncccc1N(C)C(=S)c3cccnc23 Log Solubility:	<float>-4.634</float>	CCN2c1ncccc1N(C)C(=S)c3cccnc23	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cc(Cl)c(cc1Cl)c2cccc(Cl)c2Cl Log Solubility:	<float>-7.21</float>	Clc1cc(Cl)c(cc1Cl)c2cccc(Cl)c2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN(CC)c1nc(Cl)nc(NC(C)C)n1 Log Solubility:	<float>-3.785</float>	CCN(CC)c1nc(Cl)nc(NC(C)C)n1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCC=C Log Solubility:	<float>-5.05</float>	CCCCCCCC=C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1cccc(N=CN(C)C)c1 Log Solubility:	<float>-2.34</float>	CNC(=O)Oc1cccc(N=CN(C)C)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)OC(=O)C Log Solubility:	<float>-0.55</float>	CC(C)OC(=O)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cccc(N)c1 Log Solubility:	<float>-0.85</float>	Cc1cccc(N)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOC2Oc1ccc(OS(C)(=O)=O)cc1C2(C)C Log Solubility:	<float>-3.42</float>	CCOC2Oc1ccc(OS(C)(=O)=O)cc1C2(C)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1=C(CCCO1)C(=O)Nc2ccccc2 Log Solubility:	<float>-2.56</float>	CC1=C(CCCO1)C(=O)Nc2ccccc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN(=O)=O Log Solubility:	<float>-0.22</float>	CCN(=O)=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC(C)(O)CC Log Solubility:	<float>-0.98</float>	CCCC(C)(O)CC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCOC(=O)CCC Log Solubility:	<float>-1.75</float>	CCCOC(=O)CCC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): BrC(Br)(Br)Br Log Solubility:	<float>-3.14</float>	BrC(Br)(Br)Br	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Brc1ccccc1 Log Solubility:	<float>-2.55</float>	Brc1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC1(CC)C(=O)NC(=O)N(C)C1=O Log Solubility:	<float>-2.23</float>	CCC1(CC)C(=O)NC(=O)N(C)C1=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)COC(=O)C Log Solubility:	<float>-1.21</float>	CC(C)COC(=O)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=Cc1ccco1 Log Solubility:	<float>-0.1</float>	O=Cc1ccco1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(I)cc1 Log Solubility:	<float>-4.03</float>	Clc1ccc(I)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc2cc3ccccc3cc2c1 Log Solubility:	<float>-6.96</float>	Cc1ccc2cc3ccccc3cc2c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): c1ccc2c(c1)c3cccc4ccc5cccc2c5c43 Log Solubility:	<float>-7.8</float>	c1ccc2c(c1)c3cccc4ccc5cccc2c5c43	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOP(=O)(OCC)OCC Log Solubility:	<float>0.43</float>	CCOP(=O)(OCC)OCC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc1ccc(Cl)cc1 Log Solubility:	<float>-2.78</float>	COc1ccc(Cl)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(Cl)cc1Cl Log Solubility:	<float>-1.55</float>	Oc1ccc(Cl)cc1Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OC4=C(C1CCC(CC1)c2ccc(Cl)cc2)C(=O)c3ccccc3C4=O Log Solubility:	<float>-5.931</float>	OC4=C(C1CCC(CC1)c2ccc(Cl)cc2)C(=O)c3ccccc3C4=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NC(=S)Nc1ccccc1 Log Solubility:	<float>-1.77</float>	NC(=S)Nc1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=C(Cn1ccnc1N(=O)=O)NCc2ccccc2 Log Solubility:	<float>-2.81</float>	O=C(Cn1ccnc1N(=O)=O)NCc2ccccc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc5cc4OCC3Oc2c1CC(Oc1ccc2C(=O)C3c4cc5OC)C(C)=C Log Solubility:	<float>-4.42</float>	COc5cc4OCC3Oc2c1CC(Oc1ccc2C(=O)C3c4cc5OC)C(C)=C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O(c1ccccc1)c2ccccc2 Log Solubility:	<float>-3.96</float>	O(c1ccccc1)c2ccccc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=c1[nH]cnc2nc[nH]c12 Log Solubility:	<float>-2.296</float>	O=c1[nH]cnc2nc[nH]c12	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OCCCC=C Log Solubility:	<float>-0.15</float>	OCCCC=C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C Log Solubility:	<float>-4.42</float>	CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)C(=O)OC1=CC(=O)CC(C)(C)C1 Log Solubility:	<float>-0.85</float>	CN(C)C(=O)OC1=CC(=O)CC(C)(C)C1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc2ccccc2c1 Log Solubility:	<float>-2.28</float>	Oc1ccc2ccccc2c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNc1nc(NC(C)(C)C)nc(SC)n1 Log Solubility:	<float>-4.0</float>	CCNc1nc(NC(C)(C)C)nc(SC)n1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cccc(Cl)c1c2c(Cl)cccc2Cl Log Solubility:	<float>-7.39</float>	Clc1cccc(Cl)c1c2c(Cl)cccc2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN2C(=C(O)c1ccccc1S2(=O)=O)C(=O)Nc3ccccn3 Log Solubility:	<float>-4.16</float>	CN2C(=C(O)c1ccccc1S2(=O)=O)C(=O)Nc3ccccn3	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc2ncc1nccnc1n2 Log Solubility:	<float>-1.947</float>	Oc2ncc1nccnc1n2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1 Log Solubility:	<float>-3.9</float>	CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2 Log Solubility:	<float>-8.402000000000001</float>	CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccccc1C Log Solubility:	<float>-3.76</float>	CC(C)c1ccccc1C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc(O)c(C)c1 Log Solubility:	<float>-1.19</float>	Cc1ccc(O)c(C)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC Log Solubility:	<float>-6.144</float>	CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CSc1nc(nc(n1)N(C)C)N(C)C Log Solubility:	<float>-2.676</float>	CSc1nc(nc(n1)N(C)C)N(C)C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1N(=O)=O Log Solubility:	<float>-2.33</float>	Cc1ccccc1N(=O)=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCc1ccccc1 Log Solubility:	<float>-3.37</float>	CCCc1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2 Log Solubility:	<float>-1.13</float>	CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC(C)(C)CO Log Solubility:	<float>-1.04</float>	CCC(C)(C)CO	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(C=O)cc1 Log Solubility:	<float>-0.96</float>	Oc1ccc(C=O)cc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)c1ccccc1 Log Solubility:	<float>-1.92</float>	CN(C)c1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2 Log Solubility:	<float>-7.2</float>	ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Nc1cc(nc(N)n1=O)N2CCCCC2 Log Solubility:	<float>-1.989</float>	Nc1cc(nc(N)n1=O)N2CCCCC2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23 Log Solubility:	<float>-4.571000000000001</float>	OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cccc(n1)C(Cl)(Cl)Cl Log Solubility:	<float>-3.76</float>	Clc1cccc(n1)C(Cl)(Cl)Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Nc3ccc2cc1ccccc1cc2c3 Log Solubility:	<float>-5.17</float>	Nc3ccc2cc1ccccc1cc2c3	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCI Log Solubility:	<float>-2.96</float>	CCCCI	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl Log Solubility:	<float>-7.42</float>	Clc1ccc(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNC(=S)NCC Log Solubility:	<float>-1.46</float>	CCNC(=S)NCC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1Cl Log Solubility:	<float>-3.52</float>	Cc1ccccc1Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)OC(=O)Nc1cccc(Cl)c1 Log Solubility:	<float>-3.38</float>	CC(C)OC(=O)Nc1cccc(Cl)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC=C Log Solubility:	<float>-2.68</float>	CCCC=C	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCBr Log Solubility:	<float>-1.09</float>	CCBr	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): c1c(OC)c(OC)C2C(=O)OCC2c1 Log Solubility:	<float>-1.899</float>	c1c(OC)c(OC)C2C(=O)OCC2c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc2c(ccc3ccccc32)c1 Log Solubility:	<float>-5.84</float>	Cc1ccc2c(ccc3ccccc32)c1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(cc1)c2cccc(Cl)c2Cl Log Solubility:	<float>-6.29</float>	Clc1ccc(cc1)c2cccc(Cl)c2Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1ccccc1C2OCCO2 Log Solubility:	<float>-1.57</float>	CNC(=O)Oc1ccccc1C2OCCO2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCCC(=O)OC Log Solubility:	<float>-3.38</float>	CCCCCCCCC(=O)OC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C(Cc1ccccc1)c2ccccc2 Log Solubility:	<float>-4.62</float>	C(Cc1ccccc1)c2ccccc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccccc1 Log Solubility:	<float>-3.27</float>	CC(C)c1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc2ncc1nccnc1n2 Log Solubility:	<float>-0.12</float>	Cc2ncc1nccnc1n2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cc(ccc1NS(=O)(=O)C(F)(F)F)S(=O)(=O)c2ccccc2 Log Solubility:	<float>-3.8</float>	Cc1cc(ccc1NS(=O)(=O)C(F)(F)F)S(=O)(=O)c2ccccc2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C=Cc1ccccc1 Log Solubility:	<float>-2.82</float>	C=Cc1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCO Log Solubility:	<float>-1.81</float>	CCCCCCCO	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1N(=O)=O Log Solubility:	<float>-2.33</float>	Cc1ccccc1N(=O)=O	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2 Log Solubility:	<float>-1.13</float>	CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CS(=O)(=O)c1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl Log Solubility:	<float>-2.154</float>	CS(=O)(=O)c1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC(C)(O)CC Log Solubility:	<float>-0.36</float>	CCC(C)(O)CC	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc2c1occc1c(OC)c3c(=O)cc(C)oc23 Log Solubility:	<float>-3.0210000000000004</float>	COc2c1occc1c(OC)c3c(=O)cc(C)oc23	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)c1ccccc1 Log Solubility:	<float>-1.92</float>	CN(C)c1ccccc1	scaffold	smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COC=O Log Solubility:	<float>0.58</float>	COC=O	scaffold	smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1[nH]c(=O)n(c(=O)c1Cl)C(C)(C)C Log Solubility:

Cc1[nH]c(=O)n(c(=O)c1Cl)C(C)(C)C

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOP(=S)(OCC)SCCSCC Log Solubility:

CCOP(=S)(OCC)SCCSCC

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN2c1cc(N(C)C)cc(C)c1NC(=O)c3cccnc23 Log Solubility:

CCN2c1cc(N(C)C)cc(C)c1NC(=O)c3cccnc23

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccc(C)cc1O Log Solubility:

CC(C)c1ccc(C)cc1O

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2 Log Solubility:

Fc1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)C(Cl)(Cl)Cl Log Solubility:

ClC(Cl)C(Cl)(Cl)Cl

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2 Log Solubility:

ClC(Cl)=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C1c2ccccc2c3ccc4ccccc4c13 Log Solubility:

C1c2ccccc2c3ccc4ccccc4c13

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl Log Solubility:

NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC(O)CC Log Solubility:

CCCC(O)CC

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCC(=O)C Log Solubility:

CCCCC(=O)C

scaffold

0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(O)cc1 Log Solubility:

Oc1ccc(O)cc1

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1cccc(N=CN(C)C)c1 Log Solubility:

CNC(=O)Oc1cccc(N=CN(C)C)c1

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC=O Log Solubility:

CCC=O

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOC(=O)c1ccc(N)cc1 Log Solubility:

CCOC(=O)c1ccc(N)cc1

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl Log Solubility:

NS(=O)(=O)c2cc1c(NCNS1(=O)=O)cc2Cl

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cc(cc(N(=O)=O)c1O)N(=O)=O Log Solubility:

Cc1cc(cc(N(=O)=O)c1O)N(=O)=O

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNc1nc(Cl)nc(NC(C)C)n1 Log Solubility:

CCNc1nc(Cl)nc(NC(C)C)n1

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cn1cnc2n(C)c(=O)n(C)c(=O)c12 Log Solubility:

Cn1cnc2n(C)c(=O)n(C)c(=O)c12

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0

smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Sc1nccc(=O)[nH]1 Log Solubility:

Sc1nccc(=O)[nH]1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Sc2nc1ccccc1s2 Log Solubility:

Sc2nc1ccccc1s2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN2c1ncccc1N(C)C(=S)c3cccnc23 Log Solubility:

CCN2c1ncccc1N(C)C(=S)c3cccnc23

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cc(Cl)c(cc1Cl)c2cccc(Cl)c2Cl Log Solubility:

Clc1cc(Cl)c(cc1Cl)c2cccc(Cl)c2Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN(CC)c1nc(Cl)nc(NC(C)C)n1 Log Solubility:

CCN(CC)c1nc(Cl)nc(NC(C)C)n1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCC=C Log Solubility:

CCCCCCCC=C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1cccc(N=CN(C)C)c1 Log Solubility:

CNC(=O)Oc1cccc(N=CN(C)C)c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)OC(=O)C Log Solubility:

CC(C)OC(=O)C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cccc(N)c1 Log Solubility:

Cc1cccc(N)c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOC2Oc1ccc(OS(C)(=O)=O)cc1C2(C)C Log Solubility:

CCOC2Oc1ccc(OS(C)(=O)=O)cc1C2(C)C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1=C(CCCO1)C(=O)Nc2ccccc2 Log Solubility:

CC1=C(CCCO1)C(=O)Nc2ccccc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCN(=O)=O Log Solubility:

CCN(=O)=O

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC(C)(O)CC Log Solubility:

CCCC(C)(O)CC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCOC(=O)CCC Log Solubility:

CCCOC(=O)CCC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): BrC(Br)(Br)Br Log Solubility:

BrC(Br)(Br)Br

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Brc1ccccc1 Log Solubility:

Brc1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC1(CC)C(=O)NC(=O)N(C)C1=O Log Solubility:

CCC1(CC)C(=O)NC(=O)N(C)C1=O

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)COC(=O)C Log Solubility:

CC(C)COC(=O)C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=Cc1ccco1 Log Solubility:

O=Cc1ccco1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(I)cc1 Log Solubility:

Clc1ccc(I)cc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc2cc3ccccc3cc2c1 Log Solubility:

Cc1ccc2cc3ccccc3cc2c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): c1ccc2c(c1)c3cccc4ccc5cccc2c5c43 Log Solubility:

c1ccc2c(c1)c3cccc4ccc5cccc2c5c43

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCOP(=O)(OCC)OCC Log Solubility:

CCOP(=O)(OCC)OCC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc1ccc(Cl)cc1 Log Solubility:

COc1ccc(Cl)cc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(Cl)cc1Cl Log Solubility:

Oc1ccc(Cl)cc1Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OC4=C(C1CCC(CC1)c2ccc(Cl)cc2)C(=O)c3ccccc3C4=O Log Solubility:

OC4=C(C1CCC(CC1)c2ccc(Cl)cc2)C(=O)c3ccccc3C4=O

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): NC(=S)Nc1ccccc1 Log Solubility:

NC(=S)Nc1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=C(Cn1ccnc1N(=O)=O)NCc2ccccc2 Log Solubility:

O=C(Cn1ccnc1N(=O)=O)NCc2ccccc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc5cc4OCC3Oc2c1CC(Oc1ccc2C(=O)C3c4cc5OC)C(C)=C Log Solubility:

COc5cc4OCC3Oc2c1CC(Oc1ccc2C(=O)C3c4cc5OC)C(C)=C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O(c1ccccc1)c2ccccc2 Log Solubility:

O(c1ccccc1)c2ccccc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): O=c1[nH]cnc2nc[nH]c12 Log Solubility:

O=c1[nH]cnc2nc[nH]c12

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OCCCC=C Log Solubility:

OCCCC=C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C Log Solubility:

CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)C(=O)OC1=CC(=O)CC(C)(C)C1 Log Solubility:

CN(C)C(=O)OC1=CC(=O)CC(C)(C)C1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc2ccccc2c1 Log Solubility:

Oc1ccc2ccccc2c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNc1nc(NC(C)(C)C)nc(SC)n1 Log Solubility:

CCNc1nc(NC(C)(C)C)nc(SC)n1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cccc(Cl)c1c2c(Cl)cccc2Cl Log Solubility:

Clc1cccc(Cl)c1c2c(Cl)cccc2Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN2C(=C(O)c1ccccc1S2(=O)=O)C(=O)Nc3ccccn3 Log Solubility:

CN2C(=C(O)c1ccccc1S2(=O)=O)C(=O)Nc3ccccn3

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc2ncc1nccnc1n2 Log Solubility:

Oc2ncc1nccnc1n2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1 Log Solubility:

CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2 Log Solubility:

CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccccc1C Log Solubility:

CC(C)c1ccccc1C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc(O)c(C)c1 Log Solubility:

Cc1ccc(O)c(C)c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC Log Solubility:

CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CSc1nc(nc(n1)N(C)C)N(C)C Log Solubility:

CSc1nc(nc(n1)N(C)C)N(C)C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1N(=O)=O Log Solubility:

Cc1ccccc1N(=O)=O

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCc1ccccc1 Log Solubility:

CCCc1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2 Log Solubility:

CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC(C)(C)CO Log Solubility:

CCC(C)(C)CO

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Oc1ccc(C=O)cc1 Log Solubility:

Oc1ccc(C=O)cc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)c1ccccc1 Log Solubility:

CN(C)c1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2 Log Solubility:

ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Nc1cc(nc(N)n1=O)N2CCCCC2 Log Solubility:

Nc1cc(nc(N)n1=O)N2CCCCC2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23 Log Solubility:

OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1cccc(n1)C(Cl)(Cl)Cl Log Solubility:

Clc1cccc(n1)C(Cl)(Cl)Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Nc3ccc2cc1ccccc1cc2c3 Log Solubility:

Nc3ccc2cc1ccccc1cc2c3

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCI Log Solubility:

CCCCI

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl Log Solubility:

Clc1ccc(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCNC(=S)NCC Log Solubility:

CCNC(=S)NCC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1Cl Log Solubility:

Cc1ccccc1Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)OC(=O)Nc1cccc(Cl)c1 Log Solubility:

CC(C)OC(=O)Nc1cccc(Cl)c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCC=C Log Solubility:

CCCC=C

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCBr Log Solubility:

CCBr

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): c1c(OC)c(OC)C2C(=O)OCC2c1 Log Solubility:

c1c(OC)c(OC)C2C(=O)OCC2c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccc2c(ccc3ccccc32)c1 Log Solubility:

Cc1ccc2c(ccc3ccccc32)c1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Clc1ccc(cc1)c2cccc(Cl)c2Cl Log Solubility:

Clc1ccc(cc1)c2cccc(Cl)c2Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CNC(=O)Oc1ccccc1C2OCCO2 Log Solubility:

CNC(=O)Oc1ccccc1C2OCCO2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCCC(=O)OC Log Solubility:

CCCCCCCCC(=O)OC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C(Cc1ccccc1)c2ccccc2 Log Solubility:

C(Cc1ccccc1)c2ccccc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC(C)c1ccccc1 Log Solubility:

CC(C)c1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc2ncc1nccnc1n2 Log Solubility:

Cc2ncc1nccnc1n2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1cc(ccc1NS(=O)(=O)C(F)(F)F)S(=O)(=O)c2ccccc2 Log Solubility:

Cc1cc(ccc1NS(=O)(=O)C(F)(F)F)S(=O)(=O)c2ccccc2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): C=Cc1ccccc1 Log Solubility:

C=Cc1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCCCCCCO Log Solubility:

CCCCCCCO

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): Cc1ccccc1N(=O)=O Log Solubility:

Cc1ccccc1N(=O)=O

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2 Log Solubility:

CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CS(=O)(=O)c1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl Log Solubility:

CS(=O)(=O)c1ccc(cc1)C(O)C(CO)NC(=O)C(Cl)Cl

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CCC(C)(O)CC Log Solubility:

CCC(C)(O)CC

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COc2c1occc1c(OC)c3c(=O)cc(C)oc23 Log Solubility:

COc2c1occc1c(OC)c3c(=O)cc(C)oc23

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): CN(C)c1ccccc1 Log Solubility:

CN(C)c1ccccc1

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smiles

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict the measured log solubility in mols per litre for this compound. Consider all molecular properties provided, especially the electronic configurations and molecular structure which influence solubility. Target Molecule (Smiles): COC=O Log Solubility:

COC=O

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smiles

Datasets:

molvision
/

ESOL-V-SMILES-0

BACE-V-SMILES Dataset

Dataset Description

Features

Dataset Statistics

Usage

Data Fields

Citation