smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)c1c([S-])ccc(Cl)c1-c1ccccc1[S-] ZINC000086862103 327159122 /nfs/dbraw/zinc/15/91/22/327159122.db2.gz UJWNDWDDUJTQHR-UHFFFAOYSA-N -2 0 294.828 4.787 2 0 CJAFRL FC(F)(F)c1ccc([S-])c(-c2ccccc2[S-])c1 ZINC000086863298 327159486 /nfs/dbraw/zinc/15/94/86/327159486.db2.gz YVNWXYPTMISBSO-UHFFFAOYSA-N -2 0 286.343 4.950 2 0 CJAFRL