smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCc1c2nc(C(=O)[O-])cc(N3CCCC3)c2cc2c(=O)cc(C(=O)[O-])oc21 ZINC000029250394 207357544 /nfs/dbraw/zinc/35/75/44/207357544.db2.gz PIAWBSBZEIOTFV-UHFFFAOYSA-N -2 0 396.399 3.290 1 5 GGBFRL O=C([O-])C(=O)N(c1ccccc1C(=O)[O-])c1cc([N+](=O)[O-])cc2ccccc21 ZINC000043061157 205082101 /nfs/dbraw/zinc/08/21/01/205082101.db2.gz ZHLSZCLBXHYDOR-UHFFFAOYSA-N -2 0 380.312 3.196 1 5 GGBFRL