smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1[n-]n(-c2ccc(C)c(C)c2)c(=O)c1C=Nc1ccc(Cl)c(C(=O)[O-])c1 ZINC000015134056 207048715 /nfs/dbraw/zinc/04/87/15/207048715.db2.gz CGQYMRQYYWTAHV-YVLHZVERSA-N -2 1 383.835 4.374 50 10 GICAML Cc1[n-]n(-c2cccc(Cl)c2)c(=O)c1C=Nc1ccc(Cl)c(C(=O)[O-])c1 ZINC000015134526 210154074 /nfs/dbraw/zinc/15/40/74/210154074.db2.gz XNWMPEJAZDHAHL-DHDCSXOGSA-N -2 1 390.226 4.410 50 10 GICAML Cc1[n-]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1ccc(Cl)c(C(=O)[O-])c1 ZINC000101141534 570815832 /nfs/dbraw/zinc/81/58/32/570815832.db2.gz WOPVIQNBXTUMSL-OQLLNIDSSA-N -2 1 390.226 4.410 50 10 GICAML