smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NC(=[NH2+])NC(=O)NC[C@H]1CO[P@@](=O)([O-])CO1 ZINC000040380744 174250759 /nfs/dbraw/zinc/25/07/59/174250759.db2.gz KPMBFVGLDNCYQR-BYPYZUCNSA-N 0 2 252.167 -1.472 1 30 CAEFLN NC(=[NH2+])NC(=O)NC[C@H]1CO[P@](=O)([O-])CO1 ZINC000040380744 174250761 /nfs/dbraw/zinc/25/07/61/174250761.db2.gz KPMBFVGLDNCYQR-BYPYZUCNSA-N 0 2 252.167 -1.472 1 30 CAEFLN NC(=[NH2+])NC(=O)NC[C@@H](CO)OC[P@@](=O)([O-])O ZINC000035259971 172091616 /nfs/dbraw/zinc/09/16/16/172091616.db2.gz GHHSSMFHIXUDTL-BYPYZUCNSA-N 0 2 270.182 -2.518 1 30 CAEFLN NC(=[NH2+])NC(=O)NC[C@@H](CO)OC[P@](=O)([O-])O ZINC000035259971 172091618 /nfs/dbraw/zinc/09/16/18/172091618.db2.gz GHHSSMFHIXUDTL-BYPYZUCNSA-N 0 2 270.182 -2.518 1 30 CAEFLN