smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCc1ccc([O-])c(/N=C/c2cc(Cl)cc(Cl)c2[O-])c1 ZINC000002571719 563309928 /nfs/dbraw/zinc/30/99/28/563309928.db2.gz NYMKJKLPTFWWPH-DJKKODMXSA-N -2 3 324.207 5.108 50 30 DKEAHL [O-]c1ccc(Cl)cc1/C=N/c1cc(-c2ccccc2)ccc1[O-] ZINC000003032485 563346501 /nfs/dbraw/zinc/34/65/01/563346501.db2.gz YXXYBWRIWALDGZ-CIAFOILYSA-N -2 3 323.779 5.169 50 30 DKEAHL CCCCCCCCCCCCCCCCP(=O)([O-])[O-] ZINC000006921194 563335019 /nfs/dbraw/zinc/33/50/19/563335019.db2.gz JDPSFRXPDJVJMV-UHFFFAOYSA-N -2 3 306.427 5.645 50 30 DKEAHL