smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOc1ccc([C@@H]([NH3+])c2ccccc2)cc1OCC ZINC000004312900 567938161 /nfs/dbraw/zinc/93/81/61/567938161.db2.gz SORPYFIKHAVNIY-KRWDZBQOSA-N 1 0 271.360 3.532 30 0 CHACRO CCOc1ccc([C@H]([NH3+])c2ccccc2)cc1OCC ZINC000004312899 567938172 /nfs/dbraw/zinc/93/81/72/567938172.db2.gz SORPYFIKHAVNIY-QGZVFWFLSA-N 1 0 271.360 3.532 30 0 CHACRO