SMILES stringlengths 9 127 | Count int64 1 1 |
|---|---|
[H][C+]1[NH2+][C]([H])([H])[C@]2([O]1)[C]([H])([H])[N@H+]([C]([H])([H])[H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C@]2([O]1)[C]([H])([H])[O][C@]2([H])[C]([H])([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C@]2([O]1)[C]([H])([H])[O][C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C@]23[N@H+]1[C@@]2([H])[C]([H])([H])[O][C]3([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]([C]#[N])([C]#[N])[N]1[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]([C]#[N])([C]#[N])[O]1 | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]([C]([H])([H])[C]([H])([H])[H])([C]([H])([H])[C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]([C]([H])([H])[H])([C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]([H])([H])[N@H+]1[C@]([H])([C]#[N])[C]([H])([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]2([O]1)[C]([H])([H])[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]([H])([H])[C]2([O]1)[C]([H])([H])[O][C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([CH]([NH2+][C]([H])([H])[H])[N]1[H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[N]1[H])[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[N]1[H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[N]1[H])[C]([H])([H])[O][C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[O]1)[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[O]1)[C]([H])([H])[N]([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C](=[O])[O]1)[C]([H])([H])[O][C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]([H])([H])[C]2([H])[H])[C@@]([H])([C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]2([H])[H])[C@@]([H])([C]#[N])[N]1[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]2([H])[H])[C@@]([H])([C]#[N])[O]1 | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]2([H])[H])[C@@]([H])([C]([H])([H])[C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]2([H])[H])[C@@]([H])([C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[C]2([H])[H])[C@@]([H])([O][C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O]1)[C]([H])([H])[C](=[O])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O]1)[C]([H])([H])[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O]1)[C]([H])([H])[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O]1)[C]([H])([H])[C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O]1)[C]([H])([H])[O][C]2([H])[H] | 1 |
[H][C+]1[NH2+][C]2([C]([H])([H])[O][C]2([H])[H])[C@@]([H])([C]([H])([H])[H])[O]1 | 1 |
[H][C+]1[NH][C](=[O])[C@@H]([C]([N]([H])[H])=[N+]([H])[H])[N]1[H] | 1 |
[H][C+]1[NH][C]([NH][C]([H])([H])[H])=[N][NH][N]1[H] | 1 |
[H][C+]1[NH][N]2[C@@H]([NH2+]1)[C@@]1([C]([H])([H])[H])[C]([H])([H])[C@@]21[H] | 1 |
[H][C+]1[NH][N]2[C@@H]([NH2+]1)[C@@]1([H])[C]([H])([H])[C]([H])([H])[C@@]21[H] | 1 |
[H][C+]1[NH][N]2[C@@H]([NH2+]1)[C@@]1([H])[N]([H])[C]([H])([H])[C@@]21[H] | 1 |
[H][C+]1[NH][N]2[C@@H]([NH2+]1)[C@@]1([N]([H])[H])[C]([H])([H])[C@@]21[H] | 1 |
[H][C+]1[NH][N]2[C@H]([NH2+]1)[C@@]1([H])[C@]2([H])[C@]1([H])[C]([H])([H])[H] | 1 |
[H][C+]1[N]([H])[C]([H])([H])[C@@]([H])([C](=[O])[O-])[N@H+]1[C]([H])([H])[H] | 1 |
[H][C+]1[N]([H])[C]([H])([H])[C@]2([C](=[O])[O-])[N@H+]1[C]2([H])[H] | 1 |
[H][C+]1[N]([H])[C]([H])([H])[C]([H])([C](=[O])[O-])[C]([H])([H])[N]1[H] | 1 |
[H][C+]1[N]=[N+]([C]([H])([H])[H])[c]2[n][n][n][n]21 | 1 |
[H][C+]1[N]=[N+]([H])[c]2[n][c]([N]([H])[H])[n][n]21 | 1 |
[H][C+]1[N]=[N+]([H])[c]2[n][n][c]([C]([H])([H])[H])[n]21 | 1 |
[H][C+]1[N]=[N][c]2[n]1[c]([C]([H])([H])[H])[n][n+]2[H] | 1 |
[H][C+]1[N]=[N][c]2[n]1[n][c]([N]([H])[H])[n+]2[H] | 1 |
[H][C+]1[O][C@@]2([H])[C@H]3[C@]([H])([O][C@@]3([H])[C]2([H])[H])[C]1([H])[H] | 1 |
[H][C+]1[O][C@]2([H])[C@@H]3[C@]([H])([C]1([H])[H])[C]([H])([H])[C@]3([H])[C]2([H])[H] | 1 |
[H][C+]1[O][C](=[O])[C]([NH][NH2])=[C]1[C]([H])([H])[H] | 1 |
[H][C+]1[O][C](=[O])[C]([NH][NH2])=[C]1[N]([H])[H] | 1 |
[H][C+]1[O][C]([H])([H])[C@H]2[C+]([H])[O][C]([H])([H])[C@@H]1[C]2([H])[H] | 1 |
[H][C-](/[C](=[N]/[OH])[C@]1([H])[O][C]1([H])[H])[C]([H])([H])[N]([H])[H] | 1 |
[H][C-](/[C](=[N]\[OH])[C]([H])([H])[O][C]([H])([H])[H])[C]([H])([H])[N]([H])[H] | 1 |
[H][C-](/[C]([C]#[N])=[N]/[OH])[C]([H])([H])[C]([H])([H])[N]([H])[H] | 1 |
[H][C-](/[C]([N]([H])[H])=[N+](\[H])[C]([H])([H])[H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([CH2][OH])[C](=[O])[C]#[N].[NH]=[NH] | 1 |
[H][C-]([CH2][OH])[C](=[O])[C]([H])([H])[C]([H])([H])[H].[NH]=[NH] | 1 |
[H][C-]([CH2][OH])[C](=[O])[C]([H])([H])[H].[NH]=[NH] | 1 |
[H][C-]([CH2][OH])[C](=[O])[F].[NH]=[NH] | 1 |
[H][C-]([CH2][OH])[C](=[O])[N]([H])[H].[NH]=[NH] | 1 |
[H][C-]([CH2][OH])[C](=[O])[O][C]([H])([H])[H].[NH]=[NH] | 1 |
[H][C-]([C]([N]([H])[C]([H])([H])[H])=[N+]([H])[H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([C]([N]([H])[H])=[N+]([H])[H])[C]([H])([H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([C]([N]([H])[H])=[N+]([H])[H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])/[C]([N]([H])[H])=[N+](\[H])[C]([H])([H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]#[C][C-]([H])[H].[H][N]([H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]#[C][C-]([H])[H].[H][N]([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]#[C][CH]([C]#[N])[C]#[N].[H][N]([H])[H] | 1 |
[H][C-]([H])[C]([N]([H])[C]([H])([H])[H])=[N+]([H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]([N]([H])[C]([H])([H])[H])=[N+]([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]([N]([H])[H])=[N+]([C]([H])([H])[H])[C]([H])([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[C]([N]([H])[H])=[N+]([H])[H].[O]=[C]=[O] | 1 |
[H][C-]([H])[c]1[c]([OH])[c]([C]([H])([H])[H])[n][n]1[H].[H][N]([H])[H] | 1 |
[H][C-]([H])[c]1[n][nH][c](=[O])[o]1.[H][N]([H])[H] | 1 |
[H][C-]([H])[c]1[o][n][c]([C]([H])([H])[H])[c]1[OH].[H][N]([H])[H] | 1 |
[H][C-]([H])[c]1[o][n][c]([N]([H])[H])[c]1[OH].[H][N]([H])[H] | 1 |
[H][C-]([c]1[n][nH][c](=[O])[o]1)[C]([H])([H])[H].[H][N]([H])[H] | 1 |
[H][C-]1[C@@H]([C]#[N])[C]1([H])[H].[H][N]([H])[H].[O]=[C]=[O] | 1 |
[H][C-]1[C@@H]2[C@@]([H])([C]([H])([H])[H])[N@@H+]3[C@]([C]([H])([H])[H])([C]1([H])[H])[C@]23[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([C]([H])([H])[H])[N@H+]([C@@]3([H])[C]1([H])[H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@@]4([H])[C@]2([H])[C@@]2([H])[C@]1([H])[C@@]2([H])[C@@]34[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@@]4([H])[C@]2([H])[C@@]2([H])[C@]1([H])[C@]3([H])[C@@]42[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@@]4([H])[C@]2([H])[C@@]4([H])[C@@]3([H])[C@@]1([H])[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@@]4([H])[O][C@]2([H])[C@@]4([H])[C@@]3([H])[C]1([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]([H])([O][C@@]3([H])[C]1([H])[H])[C@]2([H])[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]2([H])[C@@]2([N@H+]([C]([H])([H])[H])[C@]32[H])[C]1([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]2([H])[C@]2([C]1([H])[H])[C@]([H])([C]([H])([H])[H])[C@]32[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]2([H])[C@]2([C]1([H])[H])[C]([H])([H])[C@]32[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]4([H])[C]([H])([H])[N@@H+]([C@]24[H])[C@@]3([H])[C]1([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C@]4([H])[N@@H+]5[C@@]3([H])[C@@]1([H])[C@]5([H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[C]([H])([H])[N@@H+]4[C@@]3([H])[C@]([H])([C]1([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@@]([H])([C]([H])([H])[C@]24[H])[C@@]3([H])[C]1([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@@]3([H])[C@]([H])([C]1([H])[H])[C@]24[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@@]3([H])[C@]([H])([O][C]1([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@]([C]([H])([H])[H])([C@@]3([H])[C]1([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@]([H])([C@@]3([C]([H])([H])[H])[C]1([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@]([H])([C@@]3([H])[C@@]1([H])[C]([H])([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C@]([H])([C@]1([H])[C]3([H])[H])[C@]24[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@@H+]4[C]([H])([H])[C@]([H])([C@@]3([H])[C]1([H])[H])[C@]24[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@H+]([C@@]3([H])[C]1([H])[H])[C@]2([H])[C]([H])([H])[C]([H])([H])[H] | 1 |
[H][C-]1[C@@H]2[C@@]3([H])[N@H+]([C@@]3([H])[C]1([H])[H])[C@]2([H])[C]([H])([H])[H] | 1 |
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