smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=S(=O)(Oc1cccc(OS(=O)(=O)C(F)(F)F)c1I)C(F)(F)F 1857788283 BAXAOBUWIHOQKG-UHFFFAOYSA-N 500.132 2.748 70 20 KFID O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCCOCCOCCOCCOCCOCCOCCC(=O)Oc1c(F)c(F)c(F)c(F)c1F 2332239833 GXLWAKRKYSWKJQ-WURXVLGASA-N 745.761 2.619 70 20 KFID