smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)c1[nH]cnc1N=NN(C)CCO ZINC000001691766 170286482 /nfs/dbraw/zinc/28/64/82/170286482.db2.gz HIYZPSOAIKYDFP-OUKQBFOZSA-N 0 2 241.251 0.509 1 10 BCCFLN O=c1c2c(O)c(O)c(O)cc2ccc(O)c1O ZINC000027427049 183001001 /nfs/dbraw/zinc/00/10/01/183001001.db2.gz DFUMZQXIGVXYQM-UHFFFAOYSA-N 0 2 236.179 0.728 1 10 BCCFLN