smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1NC(=Nc2cccc(Cl)c2Cl)SC1=Cc1c(=O)[nH]c(=S)n(-c2ccccc2)c1O ZINC000103779201 569838124 /nfs/dbraw/zinc/83/81/24/569838124.db2.gz QJTDRORNTQMABD-HOXUKUGESA-N -2 2 491.381 3.792 40 30 JHEBLL O=C1NC(=Nc2cccc(Cl)c2Cl)SC1=Cc1c(=O)[nH]c(=S)n(-c2ccccc2)c1O ZINC000103779196 569838071 /nfs/dbraw/zinc/83/80/71/569838071.db2.gz QJTDRORNTQMABD-RLIURORJSA-N -2 2 491.381 3.792 40 30 JHEBLL