label
int64 0
220
| SELFIES
stringlengths 0
5.35k
|
---|---|
112 |
[C] [O] [C] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [C] [Branch2] [Branch1] [Ring1] [N] [Branch2] [Ring1] [Branch1] [C] [C] [C] [N] [C] [C] [C] [Branch1] [=Branch2] [N] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [C] [Ring1] [O] [C] [=C] [C] [=C] [N] [=C] [C] [Branch1] [O] [C] [C] [=N] [N] [Branch1] [C] [C] [C] [=Ring1] [=Branch1] [=N] [C] [Ring1] [N] [=C] [Ring1] [S] [=C] [Ring2] [Ring2] [#Branch1] .[Cl]
|
129 |
[N] [C@H1] [C] [C] [C@H1] [Branch2] [Ring2] [=N] [N] [C] [C] [=C] [Branch2] [Ring1] [O] [N] [C] [=C] [C] [=C] [Branch1] [S] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=C] [Ring1] [#C] [N] [N] [=C] [N] [=C] [Ring1] [Branch1] [N] [=Ring2] [Ring1] [=Branch2] [C] [C] [Ring2] [Ring1] [S]
|
57 |
[N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [Branch2] [Ring2] [O] [C] [Branch1] [C] [N] [C] [=Branch1] [C] [=O] [N] [C] [C@H1] [Branch1] [C] [F] [C] [C@H1] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [C] [Branch1] [#Branch2] [O] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [Ring1] [O] [=C] [C] [=C] [C] [=C] [N] [Ring2] [Ring1] [P] [Ring1] [=Branch1]
|
122 |
[C] [O] [C] [=C] [C] [=C] [Branch2] [Ring2] [Branch1] [C] [Branch2] [Ring1] [#Branch2] [C] [=Branch1] [C] [=O] [O] [C] [C] [N] [C] [C] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [N] [C] [C] [C] [C] [Ring2] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [N] .[Cl]
|
119 |
[N] [#C] [C] [=C] [C] [=C] [Branch2] [Ring1] [N] [N] [C] [C@H1] [Branch1] [Ring1] [C] [N] [C@@H1] [Branch1] [=N] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [=C] [Ring1] [#Branch1] [F] [C] [C] [Ring1] [S] [=O] [C] [=N] [Ring2] [Ring1] [#Branch1]
|
185 |
[O] [=C] [Branch2] [Ring1] [Ring2] [N] [C] [=C] [C] [=C] [Branch1] [=Branch2] [C] [N] [C] [=N] [C] [=N] [Ring1] [Branch1] [C] [=C] [Ring1] [N] [C] [=C] [C] [Branch2] [Ring1] [C] [N] [Branch1] [#Branch1] [C] [C] [C] [C] [Ring1] [Ring1] [C] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [=N] [C] [=N] [Ring1] [P]
|
209 |
[C] [N] [C] [=C] [Branch2] [Branch1] [N] [C] [C] [C] [C] [N] [Ring1] [Branch1] [C] [=N] [C] [=C] [C] [Branch1] [O] [C] [=N] [O] [C] [=Branch1] [C] [=O] [NH1] [Ring1] [=Branch1] [=N] [C] [Branch1] [N] [C] [=C] [N] [=C] [C] [Branch1] [C] [Cl] [=C] [Ring1] [#Branch1] [=C] [Ring2] [Ring1] [Ring1] [N] [Ring2] [Ring1] [=Branch1] [C] [C@H1] [C] [C] [C@H1] [Branch1] [C] [C] [C] [C] [Ring1] [#Branch1] [N] [=N] [Ring2] [Ring2] [Branch2]
|
139 |
[C] [C] [=C] [C] [Branch1] [=Branch2] [O] [C@@H1] [C] [C] [O] [C] [Ring1] [Branch1] [=C] [C] [Branch1] [S] [C] [=Branch1] [C] [=O] [N] [C] [=N] [C] [Branch1] [C] [C] [=C] [S] [Ring1] [=Branch1] [=N] [Ring2] [Ring1] [Branch1]
|
132 |
[O] [=C] [Branch2] [Ring1] [#C] [C] [=C] [C] [=C] [C] [Branch2] [Ring1] [Ring1] [C] [C] [=N] [NH1] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [O] [Ring1] [=Branch1] [=C] [Ring2] [Ring1] [C] [N] [C] [C] [N] [Branch1] [Ring2] [C] [C] [O] [C] [C] [Ring1] [=Branch2]
|
28 |
[C] [N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [Branch1] [C] [F] [=C] [Branch1] [C] [F] [C] [Branch2] [Ring2] [=Branch1] [C] [=C] [N] [=C] [C] [=C] [Branch1] [O] [C] [C] [=N] [N] [Branch1] [C] [C] [C] [=Ring1] [=Branch1] [C] [Branch1] [=Branch2] [O] [C@H1] [C] [C] [O] [C] [Ring1] [Branch1] [=N] [N] [Ring2] [Ring1] [Branch1] [Ring2] [Ring1] [C] [=C] [Ring2] [Ring1] [=N]
|
129 |
[C] [=C] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [Branch2] [Branch1] [C] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [N] [C] [C] [C] [C] [Branch2] [Ring1] [#C] [N] [C] [=N] [C] [=C] [Branch2] [Ring1] [Ring2] [S] [C] [C] [=N] [C] [=C] [Branch1] [=Branch2] [C] [Branch1] [C] [C] [Branch1] [C] [C] [C] [O] [Ring1] [=Branch2] [S] [Ring1] [S] [C] [Ring2] [Ring1] [#Branch1] [C] [=C] [Ring2] [Ring1] [S]
|
147 |
[C] [N] [Branch1] [C] [C] [C] [C] [O] [C] [=C] [C] [=C] [Branch2] [Ring1] [=Branch1] [C] [=N] [C] [=C] [Branch1] [=N] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring1] [#Branch2] [O] [Ring1] [=N] [C] [=C] [Ring2] [Ring1] [Ring1]
|
180 |
[C] [C@@H1] [C] [N] [Branch2] [Ring1] [Ring2] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [C] [C] [N] [Ring1] [P] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [Branch1] [Branch2] [N] [C] [C] [C] [C] [Ring1] [Branch1] [=C] [Ring1] [O]
|
80 |
[C] [=C] [C] [=C] [Branch2] [Ring2] [O] [C] [N] [C] [=C] [N] [=C] [Ring1] [Branch1] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [N] [Branch1] [=C] [C] [=N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [S] [Ring1] [=Branch2] [C] [C] [Ring2] [Ring1] [Branch1] [C] [=C] [Ring2] [Ring1] [P]
|
8 |
[C] [O] [C] [=C] [C] [Branch2] [Branch1] [Ring2] [C] [=Branch1] [C] [=O] [C] [=C] [S] [C] [Branch2] [Ring2] [Branch1] [C] [=C] [C] [=C] [Branch2] [Ring1] [=Branch2] [N] [C] [=Branch1] [C] [=O] [C] [C] [C] [C] [C] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [C] [=C] [Ring2] [Ring1] [Branch2] [=N] [Ring2] [Ring1] [=N] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [Ring2] [Ring2] [#Branch1] [O] [C]
|
84 |
[C] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [Branch2] [Ring2] [Branch1] [C] [=Branch1] [C] [=O] [N] [C] [C@@H1] [Branch1] [C] [O] [C] [N] [C] [C] [C] [Branch1] [S] [O] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [Branch1] [C] [Cl] [=C] [Ring1] [Branch2] [C] [C] [Ring1] [#C] [=C] [NH1] [C] [=Branch1] [C] [=O] [C] [Ring2] [Ring1] [=N] [=C] [Ring2] [Ring1] [P]
|
28 |
[C] [C] [Branch1] [C] [C] [Branch1] [Ring1] [C] [O] [N] [C] [=C] [Branch2] [Ring1] [P] [C] [=Branch1] [C] [=O] [C] [=C] [N] [=C] [C] [Branch2] [Ring1] [C] [N] [C] [=Branch1] [C] [=O] [C] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [=N] [Ring1] [#Branch1] [=C] [Ring1] [P] [C] [=C] [N] [=C] [Branch1] [C] [N] [N] [=C] [Ring1] [#Branch1] [Ring2] [Ring1] [=N]
|
152 |
[N] [#C] [C] [=C] [C] [=C] [C] [Branch2] [Ring1] [=N] [N] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [N] [C] [C] [C] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [=N] [=C] [Ring2] [Ring1] [#Branch2]
|
144 |
[O] [=C] [Branch1] [C] [O] [C] [=C] [C] [=C] [Branch2] [Ring2] [C] [N] [C] [=N] [C] [=C] [C] [=C] [C] [=N] [C] [Branch1] [C] [O] [=C] [Ring1] [#Branch1] [N] [Branch1] [Branch2] [C] [C] [C] [C] [C] [Ring1] [Branch1] [C] [Ring1] [#C] [=N] [Ring2] [Ring1] [Ring1] [N] [=C] [Ring2] [Ring1] [#Branch2]
|
212 |
[N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [Branch1] [P] [C] [=C] [C] [=C] [Branch1] [#Branch1] [O] [C] [Branch1] [C] [F] [F] [C] [=C] [Ring1] [#Branch2] [=C] [C] [=C] [C] [=C] [C] [Ring1] [=Branch1] [=N] [Ring2] [Ring1] [Ring2]
|
174 |
[C] [C] [=C] [N] [=C] [Branch1] [#Branch2] [N] [C] [=C] [C] [=N] [N] [Ring1] [Branch1] [C] [N] [=C] [Ring1] [=N] [C] [C] [=C] [N] [Branch1] [Ring2] [C] [=Ring1] [Branch1] [C] [=Branch1] [C] [=O] [N] [Branch2] [Ring1] [Ring2] [C@H1] [Branch1] [Ring1] [C] [O] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [Branch1] [C] [Cl] [=C] [Ring1] [Branch2] [C] [Ring2] [Ring1] [C]
|
60 |
[O] [=C] [Branch2] [Ring1] [Branch2] [C] [N] [C] [C] [N] [Branch1] [=N] [C] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [=C] [Ring1] [#Branch1] [C] [C] [Ring1] [=C] [N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C@H1] [Ring1] [=Branch2] [C] [F]
|
154 |
[C] [C] [C@@H1] [C] [C@H1] [Branch2] [Ring2] [=C] [N] [Branch2] [Ring1] [=C] [C] [C] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [Ring1] [=C] [C] [N] [=N] [N] [Branch1] [Ring2] [C] [C] [O] [N] [=Ring1] [Branch2] [C] [=N] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [C] [=C] [Ring1] [#Branch2] [N] [Ring2] [Ring2] [=Branch1] [C] [=Branch1] [C] [=O] [O] [C] [Branch1] [C] [C] [C]
|
27 |
[C] [C] [=C] [Branch2] [Ring1] [Ring2] [C] [=C] [C] [=C] [Branch1] [#Branch2] [C] [=C] [C] [=C] [N] [=C] [Ring1] [=Branch1] [Cl] [C] [=C] [Ring1] [=N] [N] [=C] [C] [=C] [C] [=C] [C] [Ring1] [=Branch1] [=C] [Ring2] [Ring1] [#Branch1] [C] [=Branch1] [C] [=O] [O]
|
31 |
[C] [C] [C] [C] [Branch2] [Ring1] [#Branch1] [C] [=C] [C] [=C] [Branch1] [=N] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [=Branch1] [C] [=O] [O] [C] [=C] [Ring1] [=C] [N] [C] [=C] [Branch2] [Ring1] [Branch1] [C] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [C] [=C] [Ring1] [#Branch2] [O] [C] [C] [=C] [C] [=C] [Branch1] [N] [C] [=C] [C] [=C] [Branch1] [C] [C] [C] [=C] [Ring1] [#Branch1] [C] [=C] [Ring1] [=N] [Ring2] [Ring1] [N]
|
122 |
[C] [N] [Branch2] [Ring1] [Ring2] [C] [=Branch1] [C] [=O] [C] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [Branch1] [C] [Cl] [=C] [Ring1] [Branch2] [C@@H1] [C] [C] [C] [C] [C@@H1] [Ring1] [=Branch1] [N] [C] [C] [C] [C] [Ring1] [Branch1]
|
173 |
[C] [C] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [Branch2] [Branch1] [Branch2] [C] [C] [N] [Branch2] [Ring2] [=N] [C] [C] [C] [Branch2] [Ring1] [N] [C] [=Branch1] [C] [=O] [N] [C] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [Ring1] [O] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1] [C] [C] [Ring2] [Ring1] [#C] [O] [Ring2] [Ring2] [Branch2]
|
161 |
[C] [C] [N] [Branch1] [Ring1] [C] [C] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [C] [N] [C] [=N] [C] [Branch1] [N] [N] [C] [C] [N] [Branch1] [C] [C] [C] [C] [Ring1] [#Branch1] [=N] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [=C] [Ring2] [Ring1] [C] [Ring1] [#Branch1]
|
137 |
[F] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [S] [C] [=Branch1] [C] [=S] [N] [C] [C] [N] [=C] [Ring1] [#Branch2] [Ring1] [Branch1]
|
152 |
[O] [=C] [Branch2] [Ring2] [C] [N] [C] [C] [C@H1] [C] [C] [C@H1] [Branch1] [Ring2] [C] [Ring1] [#Branch1] [N] [Ring1] [=Branch1] [C] [C] [=C] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [C] [Ring1] [#Branch1] [=C] [Ring1] [O] [N] [C] [C] [N] [Branch1] [P] [C] [=Branch1] [C] [=O] [C] [=C] [Branch1] [C] [Cl] [C] [=C] [C] [=C] [Ring1] [#Branch1] [Cl] [C] [C] [Ring1] [S]
|
207 |
[C] [C] [Branch1] [C] [C] [C] [C] [C] [Branch2] [=Branch1] [P] [C] [N] [C] [C] [N] [Branch2] [=Branch1] [Ring2] [C] [=C] [C] [=C] [Branch2] [Ring2] [Branch2] [C] [=Branch1] [C] [=O] [N] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [Branch1] [O] [O] [C] [C] [C] [C] [C] [O] [C] [Ring1] [=Branch1] [C] [Branch1] [=Branch1] [N+1] [=Branch1] [C] [=O] [O-1] [=C] [Ring1] [P] [C] [Branch1] [#C] [O] [C] [=C] [N] [=C] [NH1] [C] [=C] [C] [Ring1] [Branch1] [=C] [Ring1] [=Branch2] [=C] [Ring2] [Ring2] [#Branch1] [C] [C] [Ring2] [Ring2] [=N] [=C] [Branch2] [Ring1] [Ring1] [C] [=C] [C] [=C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [C] [=C] [Ring1] [#Branch2] [C] [Ring2] [Branch1] [#C]
|
137 |
[C] [C] [C] [C] [C] [N] [N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [Branch2] [Ring1] [C] [C] [=C] [C] [=C] [Branch1] [Branch2] [C] [N] [C] [Branch1] [C] [C] [=O] [C] [=C] [Ring1] [O] [C] [=C] [Ring1] [P]
|
214 |
[C] [N] [Branch1] [C] [C] [C] [C] [O] [C] [=C] [C] [=C] [Branch2] [Branch1] [=Branch2] [N] [C] [=C] [C] [Branch2] [Ring2] [Branch2] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch2] [Ring1] [#Branch1] [N] [C] [C] [N] [C] [=Branch1] [N] [=C] [C] [=C] [Ring1] [Branch1] [C] [C] [C] [C] [Ring1] [=Branch1] [C] [Ring1] [=N] [=O] [=C] [Ring2] [Ring1] [Branch1] [C] [O] [=C] [N] [Branch1] [C] [C] [C] [Ring2] [Ring1] [=C] [=O] [N] [=C] [Ring2] [Ring2] [=Branch1]
|
80 |
[O] [=S] [=Branch1] [C] [=O] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [C] [C@H1] [O] [C] [C] [C] [C] [Ring1] [Branch2] [C] [Ring1] [#Branch1] [C] [Ring1] [=Branch1] [C] [C] [N] [Branch1] [#Branch1] [C] [C] [C] [C] [Ring1] [Ring1] [C] [Ring1] [=C] [C] [C] [=C] [C] [=C] [Branch1] [C] [O] [C] [=C] [Ring1] [#Branch1] [Ring1] [P]
|
211 |
[C] [C] [=C] [C] [=C] [Branch1] [Branch2] [N] [N] [=C] [C] [=N] [Ring1] [Branch1] [C] [Branch2] [Ring2] [C] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [C] [C@H1] [Ring1] [=Branch1] [C] [N] [C] [=C] [C] [Branch1] [N] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=N] [Ring1] [#Branch1] [=N] [Ring1] [N] [=C] [Ring2] [Ring1] [S]
|
120 |
[C] [O] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [Branch2] [Ring1] [=C] [C] [=N] [C] [Branch1] [#C] [N] [C] [C] [C] [C] [C] [Branch1] [Ring2] [C] [Ring1] [#Branch1] [O] [Ring1] [=Branch1] [=C] [S] [C] [=C] [C] [Ring1] [Branch1] [=N] [Ring1] [P] [C] [=C] [Ring2] [Ring1] [#Branch1]
|
182 |
[N] [C] [Branch2] [Ring2] [Branch1] [C] [=C] [C] [=C] [Branch2] [Ring1] [=Branch2] [C] [N] [=C] [C] [Branch1] [C] [Br] [=C] [C] [=C] [N] [Ring1] [#Branch1] [C] [=Ring1] [#Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [=Branch1] [C] [C] [C] [Ring2] [Ring1] [#Branch2]
|
196 |
[C] [#C] [C] [N] [C] [C] [C] [Branch1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [O] [Branch2] [Ring1] [#C] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [Branch1] [=C] [O] [C] [=C] [C] [=C] [Branch1] [Ring1] [O] [C] [C] [=C] [Ring1] [Branch2] [C] [=C] [Ring1] [#C] [C] [C] [Ring2] [Ring1] [N]
|
176 |
[C] [C] [=N] [C] [=C] [C] [=C] [Branch2] [Ring2] [=Branch2] [N] [N] [=C] [C] [Branch2] [Ring1] [=N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [Branch1] [#Branch2] [C] [N] [C] [C] [O] [C] [C] [Ring1] [=Branch1] [=C] [C] [=C] [Ring1] [=N] [NH1] [Ring1] [S] [=C] [Ring2] [Ring1] [#Branch1] [N] [C] [=C] [Ring2] [Ring1] [=C] [NH1] [Ring2] [Ring1] [P]
|
78 |
[C] [N] [C] [C] [C] [N] [Branch2] [Ring1] [Branch1] [C] [=C] [C] [=C] [Branch1] [C] [O] [C] [=C] [Ring1] [#Branch1] [O] [C] [C] [=Branch1] [C] [=O] [N] [Ring1] [#Branch1] [C] [C] [Ring2] [Ring1] [Ring1]
|
214 |
[C] [C] [Branch1] [C] [C] [Branch1] [C] [C] [O] [C] [=Branch1] [C] [=O] [N] [C] [C@@H1] [C] [N] [C] [=C] [Branch1] [=Branch1] [C] [Branch1] [C] [N] [=O] [C] [Branch2] [Ring1] [Ring2] [C] [=C] [C] [=C] [Branch1] [#Branch2] [O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=C] [Ring1] [=N] [=N] [N] [Ring2] [Ring1] [Branch1] [C@H1] [Ring2] [Ring1] [=Branch2] [C] [Ring2] [Ring1] [N]
|
10 |
[C] [C] [=C] [C] [=C] [C] [Branch2] [Ring2] [#Branch2] [N] [Branch1] [C] [C] [C] [=C] [C] [=N] [C] [Branch2] [Ring1] [#Branch2] [N] [C] [=C] [C] [=C] [Branch1] [#C] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [C] [=C] [Ring1] [S] [=N] [Ring2] [Ring1] [#Branch1] [=C] [C] [Ring2] [Ring1] [#C] [=N] [N] [Ring2] [Ring2] [C] [C]
|
91 |
[O] [=C] [Branch1] [O] [C] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [O] [C] [C] [C] [=C] [C] [=C] [Branch1] [C] [O] [C] [Branch1] [C] [O] [=C] [Ring1] [Branch2]
|
100 |
[C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [S] [C] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch1] [C] [F] [=C] [Ring1] [Branch2] [C@H1] [Branch1] [C] [O] [C] [N] [C] [Branch2] [Ring1] [C] [C] [=C] [C] [=C] [C] [Branch1] [Branch2] [N] [C] [=C] [C] [=N] [Ring1] [Branch1] [=C] [Ring1] [O] [C] [C] [Ring1] [=C]
|
94 |
[C] [C] [=C] [C] [=C] [Branch2] [Branch1] [=Branch2] [C] [N] [C] [=Branch1] [C] [=O] [C] [N] [C@] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Branch2] [Ring1] [Branch2] [C@H1] [Branch1] [S] [O] [C] [=N] [C] [Branch1] [C] [C] [=C] [C] [Branch1] [C] [C] [=N] [Ring1] [Branch2] [C] [=Branch1] [C] [=O] [O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring2] [Ring1] [#C] [C] [=C] [Ring2] [Ring2] [=Branch1]
|
137 |
[O] [=C] [Branch2] [Ring1] [S] [C] [O] [C] [=C] [C] [=C] [C] [=C] [Branch1] [=N] [/C] [=C] [/S] [C] [=Branch1] [C] [=O] [N] [C] [Ring1] [=Branch1] [=O] [C] [=C] [C] [Ring1] [=C] [=C] [Ring2] [Ring1] [C] [N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1]
|
93 |
[C] [C] [Branch1] [C] [C] [O] [C] [=C] [C] [=C] [Branch2] [Ring1] [=C] [C] [=C] [N] [C] [=Branch1] [C] [=O] [N] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [=C] [Ring1] [N] [C] [Branch1] [C] [N] [=N] [Ring1] [P] [C] [=C] [Ring2] [Ring1] [#Branch1]
|
8 |
[C] [C] [N] [Branch1] [P] [C] [=C] [C] [=C] [Branch1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [O] [C] [=C] [Ring1] [#Branch2] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [C] [Branch1] [C] [C] [C] [=C] [Ring1] [#Branch2]
|
28 |
[C] [O] [C] [=C] [C] [=C] [Branch2] [Ring2] [=N] [N] [C] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [Branch2] [Ring1] [O] [C] [=C] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=N] [C] [=N] [O] [C] [Branch1] [C] [N] [=C] [Ring1] [S] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [S]
|
68 |
[O] [=C] [Branch2] [Ring1] [#C] [N] [C] [C] [=C] [N] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=C] [C] [Branch1] [C] [Cl] [=C] [C] [=C] [Ring1] [#Branch1] [C] [Ring1] [P] [=O] [C] [C] [=N] [N] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=Ring1] [O]
|
39 |
[C] [C] [Branch1] [C] [C] [Branch1] [C] [C] [O] [C] [=Branch1] [C] [=O] [N] [Branch2] [Ring1] [=C] [C] [C] [O] [C] [=C] [C] [=C] [C] [Branch1] [P] [N] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=C] [Ring1] [S] [C] [=C] [C] [=N] [C] [=C] [Ring1] [=Branch1]
|
154 |
[C] [C] [Branch1] [C] [C] [N] [C] [Branch2] [Branch1] [Ring2] [C] [=Branch1] [C] [=O] [N] [C@] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Branch1] [N] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [Ring1] [O] [C] [Branch1] [C] [O] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F]
|
59 |
[C] [N] [C] [=C] [Branch2] [Ring1] [S] [C] [=C] [C] [=N] [C] [=C] [N] [=C] [Ring1] [=Branch1] [C] [Branch1] [#C] [O] [C] [C] [C] [N] [C] [C] [C] [Ring1] [=Branch1] [Branch1] [C] [F] [F] [=N] [Ring2] [Ring1] [Ring2] [C] [=N] [Ring2] [Ring1] [=Branch2]
|
67 |
[C] [C] [C] [N] [C] [=Branch1] [C] [=O] [C] [N] [=C] [Branch2] [Ring1] [C] [C] [=C] [C] [=C] [Branch1] [Branch2] [/C] [=C] [/C] [=Branch1] [C] [=O] [O] [C] [=C] [Ring1] [O] [NH1] [C] [=Ring1] [S] [N] [Branch1] [Ring2] [C] [C] [C] [C] [Ring2] [Ring1] [Branch2] [=O]
|
142 |
[C] [C] [C] [C] [=N] [N] [Branch1] [C] [C] [C] [C] [=Branch1] [C] [=O] [NH1] [C] [Branch2] [Ring2] [Branch1] [C] [=C] [C] [Branch2] [Ring1] [=Branch1] [C] [Branch1] [Ring1] [O] [C] [C] [=C] [C] [=C] [Branch1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [O] [C] [=C] [Ring1] [#Branch2] [=C] [C] [=C] [Ring2] [Ring1] [Ring1] [O] [C] [C] [=N] [C] [Ring2] [Ring1] [P] [=Ring2] [Ring1] [=N]
|
136 |
[Cl] .[N] [C] [Branch1] [C] [N] [=N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=Branch1] [Ring2] [=C] [Ring1] [=Branch1] [C] [Branch1] [#Branch1] [C] [C] [C] [C] [Ring1] [Branch1] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring1] [=C]
|
105 |
[N] [C] [C] [C] [N] [C] [=C] [Branch2] [Ring1] [N] [C] [=C] [Branch1] [#C] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [#Branch2] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [N] [C] [Ring1] [S] [=O] [C] [=C] [C] [=C] [N] [=C] [Ring1] [=Branch1] [Ring2] [Ring1] [#Branch2]
|
158 |
[C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [Branch2] [C] [C] [C] [Branch1] [C] [N] [=O] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [Ring1] [C] [O] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [=Branch1] [C] [C] [C] [C] [N] [C] [=Branch1] [C] [=O] [N] [C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [N] [=O] [C] [=Branch1] [C] [=O] [N] [C@H1] [Branch2] [=N] [=C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [N] [C@H1] [Branch2] [O] [#C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch1] [C] [C] [=Branch1] [C] [=O] [O] [C] [=Branch1] [C] [=O] [N] [C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [=N] [C] [C] [=C] [C] [=C] [Branch1] [C] [O] [C] [=C] [Ring1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [Branch2] [C] [C] [C] [=Branch1] [C] [=O] [O] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [C] [C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [C] [C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch2] [C] [C] [C] [N] [C] [=Branch1] [C] [=N] [N] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [C] [C] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [=Branch1] [C] [C] [C] [C] [N] [C] [=Branch1] [C] [=O] [N] [C@@H1] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [C] [C] [C] [Branch1] [C] [N] [=O] [C] [Branch1] [C] [C] [C] [C] [Branch1] [C] [C] [C]
|
115 |
[C] [O] [C] [=C] [C] [=C] [Branch2] [Ring2] [Branch1] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [N] [C] [C] [N] [Branch1] [=C] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [C] [C] [C] [Ring1] [#Branch1] [C] [C] [Ring1] [#C] [C] [=Branch1] [C] [=O] [N] [O] [C] [=C] [Ring2] [Ring1] [N]
|
118 |
[C] [N] [C] [=Branch1] [C] [=O] [C] [=C] [N] [=C] [NH1] [C] [=C] [C] [Ring1] [Branch1] [=C] [Ring1] [=Branch2] [N] [C@@H1] [C] [C] [N] [Branch1] [=C] [C] [C] [=C] [C] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [Ring1] [Branch2] [C] [C@@H1] [Ring1] [#C] [F]
|
166 |
[C] [C] [C] [=C] [C] [=C] [Branch2] [Ring2] [=Branch2] [C] [C] [=C] [C] [Branch2] [Ring1] [Ring2] [C@@H1] [O] [C@H1] [Branch1] [Ring1] [C] [O] [C@@H1] [Branch1] [C] [O] [C@H1] [Branch1] [C] [O] [C@H1] [Ring1] [#Branch2] [O] [=C] [Branch1] [=Branch1] [C] [O] [C] [C] [O] [C] [=C] [Ring2] [Ring1] [=Branch1] [Cl] [C] [=C] [Ring2] [Ring1] [=C]
|
210 |
[C] [C] [N] [Branch2] [Ring2] [N] [C] [C] [=C] [C] [Branch1] [=Branch2] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [=C] [C] [=C] [Ring1] [#Branch2] [N] [C] [=C] [Branch1] [#Branch1] [C] [C] [=Branch1] [C] [=O] [O] [C] [=C] [C] [=C] [Branch1] [C] [C] [N] [=C] [Ring1] [#Branch1] [Ring1] [=C] [C] [=Branch1] [C] [=O] [C] [N] [Branch1] [C] [C] [C]
|
211 |
[C] [O] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [Ring1] [=Branch2] [C] [C] [C] [C] [C] [=Branch1] [C] [=O] [N] [Ring1] [#Branch1] [C] [C] [=C] [C] [=C] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=C] [Ring1] [N]
|
205 |
[C] [O] [C] [=C] [C] [=C] [Branch2] [Branch1] [Ring2] [C] [Branch1] [=N] [C] [=C] [C] [=C] [Branch1] [Ring1] [O] [C] [C] [=C] [Ring1] [Branch2] [N] [C] [=Branch1] [C] [=N] [N] [Branch2] [Ring1] [#Branch1] [C] [C] [C] [N] [Branch1] [=N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [=C] [C] [Ring2] [Ring1] [N] [=O] [C] [=C] [Ring2] [Ring2] [Ring1]
|
84 |
[C] [C] [Branch1] [C] [C] [C] [=Branch1] [C] [=O] [N] [C] [=N] [C] [Branch2] [Ring1] [P] [N] [N] [=C] [Branch1] [P] [C] [C] [=C] [Branch1] [C] [F] [C] [=C] [C] [Branch1] [C] [F] [=C] [Ring1] [Branch2] [F] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring2] [Ring1] [Ring1] [=N] [C] [Branch1] [C] [N] [=C] [Ring2] [Ring1] [#Branch2] [Ring2] [Ring1] [#C]
|
164 |
[C] [C] [Branch1] [C] [C] [C] [C@H1] [Branch2] [Ring1] [=Branch2] [N] [C] [=Branch1] [C] [=O] [C] [N] [C] [C] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [N] [C] [=Branch1] [C] [=O] [N] [C@H1] [Branch1] [Ring1] [C] [#N] [C] [O] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1]
|
70 |
[C] [O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [C] [C] [N] [Branch2] [Ring1] [=C] [C] [C] [C] [O] [C] [Branch2] [Ring1] [Ring1] [C] [C] [N] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [=N] [O] [Ring1] [P] [C] [C] [Ring2] [Ring1] [Branch2]
|
136 |
[C] [C] [C] [C] [N] [Branch2] [Ring1] [#C] [C] [C] [C@H1] [C] [C] [C] [N] [Ring1] [Branch1] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [#Branch2] [Ring1] [=Branch1] [C] [C] [Ring2] [Ring1] [#Branch2]
|
46 |
[C] [C] [=N] [N] [Branch1] [C] [C] [C] [=Branch1] [C] [=O] [C] [Branch2] [Ring1] [=C] [N] [C] [=Branch1] [C] [=O] [C@H1] [Branch1] [C] [C] [N] [C] [=Branch1] [C] [=O] [C] [C] [=C] [C] [Branch1] [C] [F] [=C] [C] [Branch1] [C] [F] [=C] [Ring1] [Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring2] [Ring1] [=C]
|
95 |
[C] [N] [C] [=Branch1] [C] [=N] [N] [C@] [Branch1] [C] [C] [Branch2] [Ring1] [=C] [C] [S] [C] [Branch2] [Ring1] [Ring1] [C] [=C] [C] [=N] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=C] [Ring1] [N] [=C] [C] [=Ring1] [P] [F] [C] [S] [Ring2] [Ring1] [#Branch2] [=Branch1] [C] [=O] [=O]
|
84 |
[C] [O] [C] [=C] [C] [=C] [Branch2] [Branch1] [=Branch2] [C@@H1] [Branch1] [C] [C] [N] [C@@H1] [C] [C] [C@@H1] [Branch2] [Ring2] [C] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring2] [Ring1] [C] [C] [Branch1] [C] [C] [Branch1] [C] [C] [C] [Ring2] [Ring1] [N] [C] [=C] [Ring2] [Ring2] [Branch1]
|
190 |
[C] [O] [C] [=C] [C] [Branch2] [Ring1] [S] [C] [N] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [C] [C] [C] [Branch1] [#Branch1] [C] [C] [=Branch1] [C] [=O] [O] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [C] [=C] [Ring1] [#Branch1] [Cl] [=C] [C] [=C] [Ring2] [Ring1] [=Branch2] [O] [C] [C] [N] [C] [=Branch1] [C] [=O] [C] [C] [C] [Ring1] [=Branch1] [=O]
|
35 |
[O] [=C] [N] [C] [N] [Branch1] [=Branch2] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [Ring1] [O] [C] [C] [N] [Branch1] [#Branch2] [C] [C] [=C] [C] [=C] [N] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [=N]
|
126 |
[C] [O] [C] [=C] [C] [Branch2] [Ring1] [Ring1] [C] [=Branch1] [C] [=O] [N] [C] [C@@H1] [Branch1] [C] [O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=C] [C] [=C] [Ring2] [Ring1] [C] [C] [C] [=N] [NH1] [C] [=Ring1] [Branch1]
|
130 |
[C] [O] [C] [=C] [C] [=C] [C] [Branch2] [Ring1] [O] [N] [C] [=N] [C] [Branch1] [=C] [N] [C] [Branch1] [C] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [=N] [C] [=C] [Ring1] [#C] [C] [#N] [=C] [Ring2] [Ring1] [Branch2]
|
130 |
[C] [C] [C] [C] [=Branch1] [C] [=O] [N] [Branch1] [C] [C] [C] [=C] [N] [=C] [Branch2] [Ring1] [Ring1] [N] [C] [=C] [N] [=C] [Ring1] [Branch1] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1] [N] [=C] [Ring2] [Ring1] [C] [N] [Ring2] [Ring1] [Branch2] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1]
|
48 |
[C] [C@@H1] [O] [C] [=Branch1] [C] [=O] [C@H1] [C] [=C] [C] [C] [C] [C] [C@@H1] [Ring1] [=Branch1] [C@@H1] [Branch2] [Ring1] [=Branch1] [C@@H1] [C] [C] [C] [C] [C] [Branch1] [C] [C] [Branch1] [C] [C] [N+1] [Ring1] [#Branch1] [Branch1] [C] [C] [O] [Ring1] [O] [C@@H1] [Ring2] [Ring1] [=Branch2] [Ring2] [Ring1] [Branch1] .[I-1]
|
167 |
[C] [C] [=C] [C] [Branch2] [Ring1] [=Branch1] [C] [C] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [Branch1] [#Branch1] [C] [C] [Branch1] [C] [C] [C] [S] [Ring1] [=Branch2] [=C] [C] [Branch1] [C] [C] [=C] [Ring2] [Ring1] [Ring2] [O] [C] [C] [Branch1] [C] [O] [C] [N] [C] [=Branch1] [C] [=O] [C] [O]
|
64 |
[C] [N] [C] [C] [C] [Branch2] [Ring2] [O] [N] [Branch1] [=N] [C] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=N] [Ring1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [C] [C] [=C] [C] [=C] [Branch1] [N] [O] [C] [C] [C] [Branch1] [C] [F] [Branch1] [C] [F] [F] [C] [=C] [Ring1] [=N] [C] [C] [Ring2] [Ring1] [S]
|
108 |
[N] [#C] [C] [N] [C] [=Branch1] [C] [=O] [C@H1] [Branch2] [Ring1] [Ring1] [C] [C] [=C] [C] [=C] [C] [Branch1] [Branch2] [C] [=N] [N] [=C] [O] [Ring1] [Branch1] [=C] [Ring1] [O] [N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1]
|
167 |
[C] [C] [C] [S] [C] [Branch2] [Ring1] [#C] [C] [=Branch1] [C] [=O] [C] [C] [C] [=C] [C] [Branch1] [C] [C] [=C] [Branch1] [=Branch2] [O] [C] [C@@H1] [Branch1] [C] [O] [C] [O] [C] [Branch1] [C] [C] [=C] [Ring1] [=C] [=C] [C] [=Ring2] [Ring1] [#Branch1] [C] [C] [Branch1] [Branch1] [C] [C] [Ring1] [=Branch1] [C] [C] [Ring1] [Branch1]
|
25 |
[C] [C] [=N] [C] [=C] [C] [=C] [Ring1] [=Branch1] [NH1] [C] [=C] [C] [Branch1] [Branch2] [O] [C] [C] [Branch1] [C] [C] [C] [=C] [C] [=C] [Ring1] [O] [Ring1] [=C]
|
32 |
[C] [C] [O] [C] [=C] [C] [=C] [Branch2] [Branch1] [Ring1] [C] [C] [=Branch1] [C] [=O] [C] [N] [N] [Branch1] [#Branch1] [C] [=Branch1] [C] [=O] [C] [C] [C@H1] [Branch2] [Ring1] [Ring1] [C] [=Branch1] [C] [=O] [N] [C] [C] [=C] [C] [=C] [Branch1] [Ring1] [C] [N] [C] [=C] [Ring1] [Branch2] [C@@H1] [Branch1] [C] [O] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring2] [Branch1]
|
146 |
[C] [O] [C] [=C] [C] [=C] [C] [Branch2] [Ring1] [Branch2] [C] [N] [C] [=Branch1] [C] [=O] [C] [=N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [=Branch1] [C] [=O] [NH1] [Ring1] [O] [=C] [Ring2] [Ring1] [Branch1]
|
52 |
[C] [C] [Branch1] [C] [C] [Branch1] [C] [C] [O] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [N] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [Branch1] [=C] [C] [=N] [N] [=C] [C] [=C] [C] [=C] [N] [Ring1] [=Branch2] [Ring1] [=Branch1] [N] [=C] [Ring2] [Ring1] [Ring1] [Ring1] [#C]
|
11 |
[C] [O] [C] [=C] [C] [=C] [C] [Branch2] [Branch1] [=Branch1] [C] [=C] [Branch1] [C] [C] [N] [Branch1] [O] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [F] [C] [=N] [C] [Branch2] [Ring1] [Ring2] [C] [Branch1] [C] [C] [Branch1] [C] [C] [C] [N] [C] [C] [C] [=C] [C] [=C] [C] [=N] [Ring1] [=Branch1] [=C] [N] [Ring2] [Ring1] [C] [C] [Ring2] [Ring1] [#C] [=O] [=C] [Ring2] [Ring2] [=Branch1]
|
99 |
[C] [O] [C] [=C] [C] [Branch2] [Ring2] [#Branch1] [C] [=N] [N] [Branch2] [Ring1] [Ring1] [C] [C] [C] [N] [Branch1] [=Branch2] [C] [C] [C] [O] [C] [C] [Ring1] [=Branch1] [C] [C] [Ring1] [N] [C] [=N] [C] [=N] [C] [Branch1] [C] [N] [=C] [Ring2] [Ring1] [=Branch1] [Ring1] [#Branch1] [=C] [C] [=C] [Ring2] [Ring1] [N] [N] [C] [=Branch1] [C] [=O] [C] [=N] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [Ring1] [=Branch2] [C]
|
13 |
[C] [N] [C] [=Branch1] [C] [=O] [C] [Branch2] [Ring1] [Ring1] [O] [C] [C] [=C] [C] [=C] [Branch1] [#Branch1] [C] [=Branch1] [C] [=O] [N] [O] [C] [=C] [Ring1] [#Branch2] [=C] [Branch1] [=Branch2] [C] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [Ring2] [Ring1] [=N]
|
47 |
[C] [S] [C] [=C] [C] [=C] [Branch2] [Branch1] [N] [C] [C] [=N] [C] [Branch2] [Ring2] [S] [C] [=C] [C] [=C] [Branch2] [Ring2] [Ring2] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [N] [C] [=C] [C] [=C] [Branch1] [P] [C] [C] [N] [C] [C@H1] [Branch1] [C] [O] [C] [=C] [C] [=C] [N] [=C] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [C] [C] [=C] [Ring2] [Ring1] [N] [=N] [O] [Ring2] [Ring1] [P] [C] [=C] [Ring2] [Ring2] [Branch2]
|
131 |
[C] [=C] [C] [=C] [Branch2] [Ring1] [S] [N] [C] [=N] [C] [=C] [Branch2] [Ring1] [Ring2] [C] [=C] [C] [=N] [C] [Branch1] [#Branch2] [O] [C] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [=N] [Ring1] [=N] [S] [Ring2] [Ring1] [C] [N] [=C] [Ring2] [Ring1] [=Branch2]
|
174 |
[N] [C] [=N] [C] [=C] [Branch1] [=Branch2] [C] [=C] [C] [O] [C] [C] [Ring1] [=Branch1] [N] [=C] [Ring1] [N] [C] [=C] [C] [=C] [Branch1] [#C] [C] [=Branch1] [C] [=O] [N] [C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [C] [Branch1] [C] [F] [=C] [Ring1] [P]
|
197 |
[C] [C] [Branch1] [C] [C] [Branch1] [C] [N] [C] [=Branch1] [C] [=O] [N] [C@H1] [Branch2] [Ring1] [C] [C] [O] [C] [C] [=C] [C] [Branch1] [C] [Cl] [=C] [C] [Branch1] [C] [Cl] [=C] [Ring1] [Branch2] [C] [=N] [N] [=N] [N] [Ring1] [Branch1] [C] [C] [O] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [C] [O]
|
76 |
[C] [C@H1] [C] [C] [C] [=C] [C] [=C] [Branch1] [C] [O] [C] [Branch1] [=Branch1] [N+1] [=Branch1] [C] [=O] [O-1] [=C] [Ring1] [#Branch2] [C@@] [Ring1] [=C] [Branch1] [C] [C] [C] [C] [N] [Ring1] [P] [C] [C] [C] [C] [Ring1] [Ring1]
|
106 |
[C] [C] [O] [C] [=C] [C] [=C] [Branch2] [Ring1] [#C] [C] [C] [=N] [N] [Branch1] [#Branch2] [C] [C@H1] [C] [C] [C] [N] [Ring1] [Branch1] [C] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [Ring2] [Ring1] [C] [Ring1] [=Branch1] [C] [=C] [Ring2] [Ring1] [=Branch2]
|
58 |
[C] [C] [C] [=C] [Branch2] [Ring1] [#Branch2] [C] [=Branch1] [C] [=O] [N] [C] [C] [C] [=C] [C] [=C] [Branch1] [=Branch2] [N] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [C] [=C] [Ring1] [N] [NH1] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring2] [Ring1] [O] [Ring1] [#Branch1]
|
159 |
[N] [C] [=N] [C] [=C] [C] [Branch2] [Ring2] [S] [O] [C] [=C] [C] [=C] [Branch2] [Ring2] [C] [N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [C] [=C] [C] [=C] [Ring1] [=Branch1] [N] [Branch1] [N] [C] [=C] [C] [=C] [Branch1] [C] [F] [C] [=C] [Ring1] [#Branch1] [C] [Ring1] [P] [=O] [C] [=C] [Ring2] [Ring1] [O] [F] [=C] [Ring2] [Ring2] [Ring1] [Cl]
|
0 |
[F] [C] [Branch1] [C] [F] [Branch1] [C] [F] [C] [=C] [C] [=C] [C] [Branch2] [Ring1] [=Branch2] [S] [C] [C] [=C] [C] [=N] [N] [=C] [Branch1] [=Branch2] [C] [=C] [C] [=C] [N] [=C] [Ring1] [=Branch1] [N] [Ring1] [O] [N] [=Ring1] [#C] [=C] [Ring2] [Ring1] [=Branch1]
|
58 |
[C] [C] [Branch1] [C] [C] [Branch2] [Ring2] [Branch1] [N] [C] [=Branch1] [C] [=O] [C] [=C] [C] [=C] [Branch1] [P] [N] [Branch1] [#Branch2] [C] [C] [C] [C] [C] [C] [C] [Ring1] [=Branch1] [C] [Ring1] [=N] [=O] [C] [C] [C] [C] [C] [C] [Ring2] [Ring1] [C] [C] [=Branch1] [C] [=O] [N] [C] [C] [Branch1] [C] [N] [=O]
|
176 |
[C] [=C] [C] [=Branch1] [C] [=O] [N] [C] [C] [N] [Branch2] [Ring2] [#Branch1] [C] [C] [C] [N] [N] [=C] [Branch1] [P] [C] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [C] [Branch1] [Ring1] [O] [C] [=C] [Ring1] [#Branch2] [C] [=C] [Branch1] [C] [N] [N] [=C] [N] [=C] [Ring1] [#Branch1] [Ring2] [Ring1] [Ring2] [C] [C] [Ring2] [Ring1] [=N]
|
123 |
[O] [=C] [Branch2] [Ring1] [Ring1] [C] [C] [C] [N] [Branch1] [=Branch2] [C] [=C] [C] [=N] [C] [=C] [Ring1] [=Branch1] [C] [C] [Ring1] [N] [N] [C] [C] [C@@H1] [Branch2] [Ring1] [#C] [C] [N] [S] [=Branch1] [C] [=O] [=Branch1] [C] [=O] [/C] [=C] [/C] [=C] [C] [=C] [Branch1] [O] [C] [=C] [C] [=C] [Branch1] [C] [Cl] [S] [Ring1] [=Branch1] [S] [Ring1] [O] [C] [Ring2] [Ring1] [#Branch1]
|
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