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