smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccccc4C(=O)[O-])o3)C2=O)cc1 ZINC000020248887 557003456 /nfs/dbraw/zinc/00/34/56/557003456.db2.gz UDVQTQWYQCNGTG-PDGQHHTCSA-N -1 2 432.388 4.160 10 10 IICELM Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(C(=O)[O-])cc1 ZINC000020344745 557008785 /nfs/dbraw/zinc/00/87/85/557008785.db2.gz DHDSBNKKVGECOV-NDENLUEZSA-N -1 2 447.422 4.438 10 10 IICELM