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 327159126 /nfs/dbraw/zinc/15/91/26/327159126.db2.gz UJWNDWDDUJTQHR-UHFFFAOYSA-N -1 2 294.828 4.787 2 0 CJAFLM CC(=O)c1c([S-])ccc(Cl)c1-c1ccccc1S ZINC000086862103 327159124 /nfs/dbraw/zinc/15/91/24/327159124.db2.gz UJWNDWDDUJTQHR-UHFFFAOYSA-N -1 2 294.828 4.787 2 0 CJAFLM