smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(C)C[C@H](Cn1cnc2c1ncnc2N)OC[P@](=O)([O-])O ZINC000026983184 202151205 /nfs/dbraw/zinc/15/12/05/202151205.db2.gz PBXFYMBAUXCIFL-VIFPVBQESA-O 0 1 345.320 -0.365 1 5 EBBFMN O=c1[nH]c2cc([N+](=O)[O-])cc(C[NH2+]CC[P@@](=O)([O-])O)c2[nH]c1=O ZINC000026505474 202145456 /nfs/dbraw/zinc/14/54/56/202145456.db2.gz CVVQUZACMDLTGQ-UHFFFAOYSA-N 0 1 344.220 -0.608 1 5 EBBFMN C[N+](C)(C)C[C@@H](Cn1cnc2c1ncnc2N)OC[P@](=O)([O-])O ZINC000026983176 202151459 /nfs/dbraw/zinc/15/14/59/202151459.db2.gz PBXFYMBAUXCIFL-SECBINFHSA-O 0 1 345.320 -0.365 1 5 EBBFMN C[N+](C)(CCO)Cc1cn(-c2cc(C(=O)[O-])[nH+]c(C(=O)[O-])c2)nn1 ZINC000095920600 717140602 /nfs/dbraw/zinc/14/06/02/717140602.db2.gz AQWWXXIJXFAABJ-UHFFFAOYSA-O 0 1 336.328 -0.373 1 5 in-vitro EBBFMN