smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)([O-])c1ccc(/N=N/c2nc(C(F)(F)F)c(C(F)(F)F)[n-]2)cc1 ZINC000017176269 210205626 /nfs/dbraw/zinc/20/56/26/210205626.db2.gz HLYCSXLSVNEJJL-QZQOTICOSA-N -2 0 388.249 4.109 1 10 GICFRL