SMILES stringlengths 9 127 | Count int64 1 1 |
|---|---|
[H][C]#[C][C@@]1([H])[C@@]2([O][H])[C]([H])([H])[C@@]3([H])[C@]1([H])[C@]32[H] | 1 |
[H][C]#[C][C@@]1([H])[C@@]2([O][H])[C]([H])([H])[O][C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@@]2([O][H])[C]([H])=[C]([H])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@@]2([O][H])[C]([H])=[C]([H])[C]([H])([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([N-][H])[O][C]([H])([H])[C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([N-][H])[O][C]([H])([H])[C]([H])([H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([NH][O][H])[C@@]2([H])[C]([H])([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([NH][O][H])[C@@]2([H])[O][C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([NH][O][H])[C@]2([H])[N@H+]1[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([NH][O][H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@H]([NH][O][H])[C]([H])([H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]([O][H])([C]([H])=[O])[C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([C]([H])([H])[H])[C]([H])([H])[C]([H])([H])[C@]12[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([C]([H])([H])[H])[N@@H+]3[C@@]1([H])[C@]3([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([C]([H])([H])[H])[O][C]([H])([H])[C@]12[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C@]3([H])[C@]([H])([C]([H])([H])[H])[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C@]3([H])[C@]([H])([O][H])[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C@]3([H])[C]([H])([H])[C@@]([H])([C]3([H])[H])[C@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C@]3([H])[O][C@@]1([H])[C]([H])([H])[C@@]32[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C](=[O])[C@@]1([H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C](=[O])[C@@]1([H])[C@]2([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C](=[O])[N]3[C@]2([H])[C@]31[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([C]#[C][H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([C]([H])([H])[H])[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[C]([H])=[O] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C@@]2([O][H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([O][H])[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@@]1([O][H])[C@@]2([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@]([H])([C]([H])([H])[H])[C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C@]3([C]([H])([H])[H])[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C]([H])([H])[C@@]1([H])[C@@]2([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C]([H])([H])[O][C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[C]([H])=[C]([H])[C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[O][C@@]1([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])([H])[O][C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[C]([H])=[C]([H])[C@@]1([H])[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@@H+]3[C@@]1([H])[C@]3([H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@@H+]3[C@@]1([H])[C]([H])([H])[C@@]32[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@@H+]3[C]([H])([H])[C@@]1([H])[C@@]32[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@H+]([C]([H])([H])[H])[C@@]1([H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@H+]3[C@]2([H])[C]([H])=[C]([H])[C@]31[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@H+]3[C]([H])([H])[C@]2([C]([H])([H])[H])[C@]31[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@H+]3[C]([H])([H])[C@]2([H])[C@]31[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N@H+]3[C]([H])([H])[C@]2([O][H])[C@]31[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N]([H])[C@@]1([H])[C@@]2([H])[O][C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N]([H])[C@@]1([H])[C@@]2([H])[O][H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[N]([H])[C@@]1([H])[C@@]2([O][H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([H])[O][C@]3([C]([H])([H])[H])[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@@]1([H])[C@]2([O][H])[C]([H])([H])[C]([H])([H])[C@]12[O][H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[N]([C]([H])=[O])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[N]([H])[C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[N]([H])[C](=[O])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[N]([H])[C](=[O])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C@@]([H])([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C@@]1([H])[C]#[C][H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C@@]1([H])[C]([H])=[O] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C@@]2([H])[C]([H])([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C](=[O])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([N-][H])[O][C]12[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH2+][C]([H])([H])[C]([H])([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH2+][C]([H])([H])[H])[O][C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH2+][C]([H])([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH][O][H])[C@@]([H])([C]([H])([H])[H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH][O][H])[C]([H])([H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH][O][H])[C]([H])=[C]([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[CH]([NH][O][H])[C]([H])=[C]([H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[C]([H])([H])[H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[C]([H])([H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[C]([H])=[C]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[N@@H+]1[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([C]([H])([H])[O][H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([O][C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([O][H])[C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([O][H])[C]([H])=[C]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([H])([O][H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]([O][H])([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([C]([H])([H])[H])[N]([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([C]([H])([H])[H])[O][C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([H])[C]([H])([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([H])[C]([H])([H])[C@@]2([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([H])[N@@H+]1[C@@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([H])[N]([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([H])[O][C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([O][C]2([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@@]2([O][H])[C]([H])([H])[C@@]12[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@]([H])([C]#[C][H])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@]([H])([C]#[C][H])[N]1[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@]([H])([C]#[N])[C]1([H])[H] | 1 |
[H][C]#[C][C@@]1([H])[C](=[O])[C@]([H])([C]#[N])[N]1[H] | 1 |
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