smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O[P@@](=O)([O-])O)cc1)C(=O)[O-] ZINC000036179026 563123509 /nfs/dbraw/zinc/12/35/09/563123509.db2.gz XUJHGZCBICJAJS-QHCPKHFHSA-N -2 2 499.585 5.751 10 30 JKEELL CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O[P@](=O)([O-])O)cc1)C(=O)[O-] ZINC000036179026 563123510 /nfs/dbraw/zinc/12/35/10/563123510.db2.gz XUJHGZCBICJAJS-QHCPKHFHSA-N -2 2 499.585 5.751 10 30 JKEELL