SMILES stringlengths 9 127 | Count int64 1 1 |
|---|---|
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[C@@]2([H])[O][C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[C@]12[O][C]2([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[CH]1[NH][O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[C]12[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[C]1=[O] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]([H])([H])[O][CH]1[N-][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[H])[O][C]12[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[NH+]2[C]([H])([H])[C]2([H])[H])[N]([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[NH+]2[C]([H])([H])[C]2([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][C]([H])([H])[H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][C]([H])([H])[H])[N]([H])[C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][C]([H])([H])[H])[O][C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C@@]([H])([C]([H])([H])[H])[C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C@@]([H])([O][H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C@]2([H])[C]([H])([H])[C@@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]([H])([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]1([H])[C]#[C][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]2([H])[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C@@]2([H])[N]([H])[C@@]12[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[C]([H])([H])[N@H+]2[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[N@@H+]([C]([H])([H])[C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[N@@H+]([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[N]([H])[C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[N]([H])[C@@]1([H])[C]([H])=[O] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[N]([H])[C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C@@]([H])([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C@@]1([H])[C]([H])=[O] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C@@]2([H])[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C]([H])([H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C]([H])([H])[C]([H])=[C]1[H] | 1 |
[H][C]#[C][C@]1([C]([H])([H])[O][H])[O][C]([H])([H])[C]1=[O] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C@@]([H])([O][H])[C@@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[C@@]2([H])[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[C@@]2([H])[O][C@@]12[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[C@]([H])([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[C@]([H])([O][H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[C]([H])([H])[N@H+]2[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N@@H+]([C]([H])([H])[C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N@@H+]([C]([H])([H])[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N@H+]([C]([H])([H])[H])[C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N](/[C]([H])=[N]/[H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N]([C]([H])=[O])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N]([H])[C@@]1([H])[C]#[C][H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[N]([H])[C@@]1([H])[C]#[N] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[O][C@@]2([H])[C]([H])([H])[C@]21[H] | 1 |
[H][C]#[C][C@]1([C]([H])=[O])[O][C]([H])([H])[C]([H])=[C]1[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]([H])([H])[C]2([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]2([H])[H])[C]([H])([H])[C@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]2([H])[H])[C]([H])([H])[C@]1([H])[O][H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]2([H])[H])[N]([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]2([H])[H])[O][C@]1([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[C]2([H])[H])[O][C]([H])([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[O][C]2([H])[H])[N]([H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([C]2([H])[C]([H])([H])[O][C]2([H])[H])[O][C]1([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C-]([H])[C]([H])=[C]([NH][O][H])[C]1([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@H]2[C-]([H])[C]([H])([H])[N@@H+]3[C@@]1([H])[C@]23[H] | 1 |
[H][C]#[C][C@]1([H])[C@@H]2[NH2+][C]([H])([H])[C@@]3([H])[N@@H+]2[C@@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([C]#[N])[N]([H])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([C]([H])([H])[H])[C]([H])([H])[C@]1([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([C]([H])([H])[H])[O][C]([H])([H])[C@@]12[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@@]3([H])[C@]1([H])[C@@]1([H])[C@]2([H])[C@@]31[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@@]3([H])[C]([H])([H])[C]([H])([H])[C@@]3([H])[C@@]12[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]([H])([O][H])[C@]1([H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[C@@]([H])([C]([H])([H])[H])[C@@]2([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[C@@]([H])([O][H])[C@@]2([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[C]([H])([H])[C@@]2([H])[C@]13[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[C]([H])([H])[C@@]2([H])[C@]13[O][H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[N@@H+]([C]([H])([H])[H])[C@@]2([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[N@@H+]4[C@@]2([H])[C@]4([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C@]3([H])[N]([H])[C@@]2([H])[C@]13[O][H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[CH]([N-][H])[O][C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([C]([H])([H])[H])[N]2[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([H])[C]([H])=[C]2[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([H])[N@@H+]2[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([H])[N]2[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]1([O][H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C@]3([H])[C@@]2([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[C]([H])([H])[C@]1([H])[N]2[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[N]([H])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C](=[O])[O][C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([C]([H])([H])[H])=[C]([H])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[C@@]3([H])[C@]1([H])[C@]32[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[C@@]3([H])[C@]1([H])[C@]32[O][H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[C@]1([C]([H])([H])[H])[C@]2([H])[O][H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[C@]1([H])[C@]2([H])[C]#[C][H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[C]([H])([H])[C]([H])([H])[C@]1([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[N@@H+]3[C@@]2([H])[C@@]31[C]([H])([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[N@H+]3[C@]1([H])[C@@]3([H])[C]2([H])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[C]([H])([H])[O][C]([H])([H])[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]([H])([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])[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[N@@H+]([C]([H])([H])[H])[C@]3([H])[C@@]2([H])[C@]13[H] | 1 |
[H][C]#[C][C@]1([H])[C@@]2([H])[N@@H+]3[C@@]2([H])[C@@]2([H])[C@]3([H])[C@@]12[H] | 1 |
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