smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [N-]=[N+]=N[C@]1(CO)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@@H]1O ZINC000029233377 374029920 /nfs/dbraw/zinc/02/99/20/374029920.db2.gz FHPJZSIIXUQGQE-XZMZPDFPSA-N 0 0 285.216 -2.214 30 10 CACCRN