smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1c2cc(O)c([O-])cc2-c2cccc([O-])c21 ZINC000584615869 358280369 /nfs/dbraw/zinc/28/03/69/358280369.db2.gz PDPAKZJANZUWFU-UHFFFAOYSA-N -2 3 228.203 2.015 10 10 BECEHL O=c1c2cccc([O-])c2oc2c(O)c([O-])ccc12 ZINC000014822078 343131713 /nfs/dbraw/zinc/13/17/13/343131713.db2.gz GYXLJFKBGTVCHD-UHFFFAOYSA-N -2 3 244.202 2.063 10 10 BECEHL