smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1ccc2c(c1)c1c(c3ccccc32)O1 ZINC000013520811 572494754 /nfs/dbraw/zinc/49/47/54/572494754.db2.gz MNDKYWLUKLXTOS-UHFFFAOYSA-N 0 0 192.217 4.099 10 5 AIBERN Fc1c2ccccc2cc2ccccc21 ZINC000071791101 171108804 /nfs/dbraw/zinc/10/88/04/171108804.db2.gz RDXADDJRENGLRQ-UHFFFAOYSA-N 0 0 196.224 4.132 10 5 AIBERN