smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1NC(=O)c1cc2cc3ccccc3cc2cc1O[P@@](=O)([O-])O ZINC000002507954 557353522 /nfs/dbraw/zinc/35/35/22/557353522.db2.gz AODGGAXCSNLSHI-UHFFFAOYSA-N -1 2 407.362 5.025 50 5 HKBALM Cc1ccccc1NC(=O)c1cc2cc3ccccc3cc2cc1O[P@](=O)([O-])O ZINC000002507954 557353525 /nfs/dbraw/zinc/35/35/25/557353525.db2.gz AODGGAXCSNLSHI-UHFFFAOYSA-N -1 2 407.362 5.025 50 5 HKBALM O=[N+]([O-])c1cc([N+](=O)[O-])c(Nc2ccccc2Cl)nc1[N-]c1ccccc1Cl ZINC000008386493 568996176 /nfs/dbraw/zinc/99/61/76/568996176.db2.gz VMMHIAWRZCCPDT-UHFFFAOYSA-N -1 2 420.212 5.692 50 5 HKBALM