smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1nc(NCCOC[P@@](=O)([O-])O)c([N+](=O)[O-])c(=O)[nH]1 ZINC000017220371 182079762 /nfs/dbraw/zinc/07/97/62/182079762.db2.gz UWRDMNZJYKGWRP-UHFFFAOYSA-N -1 2 309.175 -1.176 1 5 DABFLM Nc1nc(NCCOC[P@](=O)([O-])O)c([N+](=O)[O-])c(=O)[nH]1 ZINC000017220371 182079764 /nfs/dbraw/zinc/07/97/64/182079764.db2.gz UWRDMNZJYKGWRP-UHFFFAOYSA-N -1 2 309.175 -1.176 1 5 DABFLM