smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NOCc1ccc(OP(=O)([O-])[O-])c([N+](=O)[O-])c1 ZINC000071296737 176112261 /nfs/dbraw/zinc/11/22/61/176112261.db2.gz OKAYFJKIWVEGRM-UHFFFAOYSA-N -2 0 264.130 0.457 1 5 CCBFRL NOCc1cc(OP(=O)([O-])[O-])ccc1[N+](=O)[O-] ZINC000071329059 176123834 /nfs/dbraw/zinc/12/38/34/176123834.db2.gz PNARIZOCGJYQBN-UHFFFAOYSA-N -2 0 264.130 0.457 1 5 CCBFRL CC(=O)Nc1cc([N+](=O)[O-])c(C(=O)[O-])c([N+](=O)[O-])c1[O-] ZINC000013603422 170568326 /nfs/dbraw/zinc/56/83/26/170568326.db2.gz WPCARQWRKAHVHE-UHFFFAOYSA-N -2 0 285.168 0.865 1 5 CCBFRL