smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc2c(F)ccc([N+](=O)[O-])c2[nH]1 97463347 343702010 /nfs/dbraw/zinc/70/20/10/343702010.db2.gz ZYORUXPQAKOYLB-UHFFFAOYSA-N 0 0 194.165 2.524 30 5 AFBCRN