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=Nc1cc(C(=O)[O-])ccc1C ZINC000016312151 570854273 /nfs/dbraw/zinc/85/42/73/570854273.db2.gz MEWIGTUMZWWPRA-WQRHYEAKSA-N -2 3 363.417 4.029 40 10 FICBHL Cc1[n-]n(-c2ccc(C)cc2C)c(=O)c1C=Nc1cc(C(=O)[O-])ccc1C ZINC000016284813 570853792 /nfs/dbraw/zinc/85/37/92/570853792.db2.gz OIUKNQQCLOKVIU-BOPFTXTBSA-N -2 3 363.417 4.029 40 10 FICBHL Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3cc(Cl)ccc3[O-])C2=O)c1 ZINC000083308391 571100891 /nfs/dbraw/zinc/10/08/91/571100891.db2.gz JUSCTUAHQOXRBP-OQLLNIDSSA-N -2 3 370.792 4.169 40 10 FICBHL Cc1ccccc1S(=O)(=O)[N-]c1cc(Cl)c([O-])c(Cl)c1Cl ZINC000000851475 210280097 /nfs/dbraw/zinc/28/00/97/210280097.db2.gz OLKYPDBOMMBWCP-UHFFFAOYSA-N -2 3 366.653 4.462 40 10 FICBHL Cc1[n-]n(-c2cccc(Cl)c2)c(=O)c1C=Nc1cc(C(=O)[O-])ccc1C ZINC000016347101 220182423 /nfs/dbraw/zinc/18/24/23/220182423.db2.gz GVLDOOVUCWVYTM-YBEGLDIGSA-N -2 3 369.808 4.065 40 10 FICBHL