smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cccc(NCc2cc(Cl)ccc2[O-])c1 ZINC000019877219 179147849 /nfs/dbraw/zinc/14/78/49/179147849.db2.gz TZELXGABZKQNRM-UHFFFAOYSA-N -1 3 247.725 3.966 40 10 BHCBHM [S-]c1ccccc1Cc1cccs1 ZINC000087492908 183312366 /nfs/dbraw/zinc/31/23/66/183312366.db2.gz UHDRTZCEZKMPBP-UHFFFAOYSA-N -1 3 206.335 3.547 40 10 BHCBHM [O-]c1cc(O)cc(N=Nc2ccccc2)c1 ZINC000299888219 352549681 /nfs/dbraw/zinc/54/96/81/352549681.db2.gz AKEJWZBTXCLPTH-UHFFFAOYSA-N -1 3 214.224 3.513 40 10 BHCBHM