smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#Cc1c(O)[n-]c2csc(-c3ccc(-c4ccccc4O)cc3)c2c1=O ZINC000390822411 526528819 /nfs/dbraw/zinc/52/88/19/526528819.db2.gz UVQZAWOBMOOIQN-UHFFFAOYSA-N -1 2 360.394 4.206 40 30 FIEBLM Cc1cc(/C=[NH+]\C2CCCCC2)c(C)n1-c1cc(C(=O)[O-])cc(C(=O)[O-])c1 ZINC000408846520 570691649 /nfs/dbraw/zinc/69/16/49/570691649.db2.gz NVFRCYWVWMUNOG-UUYOSTAYSA-N -1 2 368.433 4.242 40 30 FIEBLM CC(C)=CCC1C(=O)[C@](O)(CC=C(C)C)C(=O)C(C(=O)CC(C)C)=C1[O-] ZINC000100071914 210181359 /nfs/dbraw/zinc/18/13/59/210181359.db2.gz VMSLCPKYRPDHLN-OAQYLSRUSA-N -1 2 362.466 4.252 40 30 in-vitro FIEBLM