smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=P([O-])(O)C(Nc1ncc(Cl)cc1Cl)[P@](=O)([O-])O ZINC000103222326 219271607 /nfs/dbraw/zinc/27/16/07/219271607.db2.gz LIZOVHXIILVVKP-UHFFFAOYSA-N -2 2 336.992 1.439 1 0 EDAFLL O=P([O-])(O)C(Nc1ncc(Cl)cc1Cl)[P@@](=O)([O-])O ZINC000103222326 219271610 /nfs/dbraw/zinc/27/16/10/219271610.db2.gz LIZOVHXIILVVKP-UHFFFAOYSA-N -4 2 336.992 1.439 1 0 EDAFLL O=P([O-])(O)C(Br)(Cc1cccnc1)[P@](=O)([O-])O ZINC000028866127 581102206 /nfs/dbraw/zinc/10/22/06/581102206.db2.gz JQDFDVDIMPCOJQ-UHFFFAOYSA-N -4 2 346.010 1.028 1 0 EDAFLL O=P([O-])(O)C(Br)(Cc1cccnc1)[P@@](=O)([O-])O ZINC000028866127 581102207 /nfs/dbraw/zinc/10/22/07/581102207.db2.gz JQDFDVDIMPCOJQ-UHFFFAOYSA-N -2 2 346.010 1.028 1 0 EDAFLL