smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features [C-]#[N+]C(C(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)COC(=O)C([N+]#[C-])=C(C)C)=C(C)C 60183592 YEMJVHOPMVQUGS-HMEQZMJYSA-N 396.396 -0.057 50 30 GBGC [C-]#[N+]C(C(=O)OC[C@H](O)[C@H](O)[C@H](O)[C@@H](O)COC(=O)C([N+]#[C-])=C(C)C)=C(C)C 256012940 YEMJVHOPMVQUGS-GVAFMPQTSA-N 396.396 -0.057 50 30 GBGC CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)CC(=O)CCl)[C@H]2SC1 5161260 IKRWLWZYTNQCOD-ZWNOBZJWSA-N 390.801 -0.514 50 30 GBGC O=C(Cn1nnc(N2CCOCC2)n1)NNC(=S)Nc1ccc(F)cc1F 1044464 MVJPTLYSSMFSPQ-UHFFFAOYSA-N 398.399 -0.194 50 30 GBGC [C-]#[N+]C(C(=O)OC[C@H](O)[C@H](O)[C@@H](O)[C@H](O)COC(=O)C([N+]#[C-])=C(C)C)=C(C)C 256012941 YEMJVHOPMVQUGS-VZAMPYOESA-N 396.396 -0.057 50 30 GBGC