smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccc2ccccc2c1C=Nn1c(=S)[n-]nc1COc1ccccc1 ZINC000102908097 526354400 /nfs/dbraw/zinc/35/44/00/526354400.db2.gz GNILVABMYIDJHP-MTJSOVHGSA-N -2 3 376.441 4.261 10 30 GIEEHL C=CCc1cccc(C=[NH+][N-]c2nnc(SCc3ccc(F)cc3)[n-]2)c1[O-] ZINC000005899358 570460991 /nfs/dbraw/zinc/46/09/91/570460991.db2.gz IUYJVLVRJYUWOR-SRZZPIQSSA-N -2 3 383.452 4.116 10 30 GIEEHL