SMILES stringlengths 9 127 | Count int64 1 1 |
|---|---|
[H][C]#[C][C@]12[O][C@]([H])([C]([H])([H])[C]1([H])[H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])([H])[C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])([H])[C]1=[O])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])([H])[H])[C@]([H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])([H])[O][C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])=[C]1[C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]([H])=[C]1[H])[C]([H])=[C]2[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@@]([H])([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@@]1([H])[C]([H])([H])[C@]12[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@@]1([H])[N]([H])[C@]12[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@@]1([H])[O][C@]12[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@]2([H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@]2([H])[O][H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@]2([O][H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1([H])[H])[C@]21[O][C]1([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]([H])([C]1=[O])[C]([H])=[C]2[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([C]([H])([H])[H])[C@@]1([H])[N]([H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([C]([H])([H])[H])[C@@]1([H])[O][C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@@]([H])([C]([H])([H])[H])[C@@]1([H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@@]1([H])[O][C]([H])([H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C@]1([H])[O][H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C]([H])([H])[C]1([H])[H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C]1([H])[H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C]1([H])[H])[C@@]32[O][H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C]1([H])[H])[C@]3([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([C]1=[O])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C@]([H])([O][C]1([H])[H])[C@@]32[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C](=[O])[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C]([H])([H])[C@@]1([H])[C@]3([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C]([H])([H])[C@]([H])([C]1([H])[H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[C]([H])([H])[N@H+]([C]1([H])[H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C@]3([H])[O][C@@]1([H])[C@@]2([H])[C]3([H])[H] | 1 |
[H][C]#[C][C@]12[O][CH]([C]([H])([H])[H])[NH2+][C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][CH]([N-][H])[C@]([H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][CH]([N-][H])[C]([H])([H])[C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][CH]([N]([H])[H])[NH2+][C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C](=[O])[N]([H])[C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C](=[O])[O][C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([C]([H])([H])[H])[C@]2([H])[O][H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([C]([H])([H])[H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([C]([H])([H])[O][H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([C]([H])=[O])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C@@]([H])([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C@@]([H])([O][H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C@@]1([H])[C]([H])([H])[C@@]21[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C@@]1([H])[N]([H])[C@@]21[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C@@]1([H])[O][C@]12[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[C]([H])([H])[C]([H])=[C]2[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([H])[N@H+]1[C]([H])([H])[C@]12[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([O][C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@@]1([O][H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([C]([H])([H])[H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([H])([C]([H])([H])[O]1)[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([H])([C]1([H])[H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([H])([C]1([H])[H])[C@]2([H])[O][H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([H])([O][C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]([O][H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]3([H])[C@@]1([H])[C]([H])([H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C@]3([H])[C@@]1([H])[N]([H])[C@]23[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C]([H])([H])[C@@]1([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C]([H])([H])[C@]([H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C]([H])([H])[N@H+]([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[C]([H])=[C]1[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[O][C@@]1([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]12[O][C]([H])([H])[O][C@]([H])([C]1([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][CH]([C]#[N])/[C]([N]([H])[H])=[N+](\[H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([C]#[N])[C]#[C][C-]([H])[H].[H][N]([H])[H] | 1 |
[H][C]#[C][CH]([C]#[N])[C]([N]([H])[H])=[N+]([H])[H] | 1 |
[H][C]#[C][CH]([C]#[N])[N+]([H])=[C]([N]([H])[H])[N]([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C@@]([H])([C]#[N])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C@@]([H])([C]([H])([H])[H])[C]([H])([H])[O][H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C@@]([H])([C]([H])=[O])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C@]([H])([C]([H])([H])[H])[C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C](=[O])[N]([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([C]([H])([H])[H])([C]([H])([H])[H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C@]([H])([O][H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]#[C][C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C](=[O])[N]([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([C]([H])([H])[H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([H])[C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([H])[C]([H])([H])[O][H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([H])[C]([H])=[O] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])([H])[C]([H])([H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]([H])=[O] | 1 |
[H][C]#[C][CH]([N-][H])[O][C]1([C]([H])([H])[H])[C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[C]([H])([H])[C]([H])([H])[H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[C]([H])([H])[H])[O][C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[C]([H])([H])[O][H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[H])[O][C]([H])([H])[C]#[C][H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[H])[O][C]([H])([H])[C]#[N] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[H])[O][C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[H])[O][C]([H])([H])[C]([H])=[O] | 1 |
[H][C]#[C][CH]([NH2+][C]([H])([H])[H])[O][C]([H])=[O] | 1 |
[H][C]#[C][CH]([NH][NH2])[C](=[O])[N]([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][CH]([NH][NH2])[C](=[O])[N]([H])[H] | 1 |
[H][C]#[C][CH]([NH][NH2])[C](=[O])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][CH]1[C]([H])=[C]([N-][H])[O][C]([H])([H])[C]1([H])[H] | 1 |
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