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)CCCC[P@](=O)([O-])CC[C@@H](O)CO ZINC000059066666 717131085 /nfs/dbraw/zinc/13/10/85/717131085.db2.gz JVJPJZKJPOLGJR-LLVKDONJSA-O 0 1 268.314 0.487 1 5 in-vitro CCBFMN C[N+](C)(C)CCCC[P@](=O)([O-])CC[C@H](O)CO ZINC000059066661 717131027 /nfs/dbraw/zinc/13/10/27/717131027.db2.gz JVJPJZKJPOLGJR-NSHDSACASA-O 0 1 268.314 0.487 1 5 in-vitro CCBFMN COC[C@H](CO[P@](=O)([O-])OCC[N+](C)(C)C)OC ZINC000001842276 560184850 /nfs/dbraw/zinc/18/48/50/560184850.db2.gz VONCWAQXCVELFQ-SNVBAGLBSA-O 0 1 286.285 0.488 1 5 in-vitro CCBFMN O=c1[nH]c2cc(CN3CCCC3)c([N+](=O)[O-])cc2[nH]c1=O ZINC000027749192 581101791 /nfs/dbraw/zinc/10/17/91/581101791.db2.gz MBMAJCHYOXLOLG-UHFFFAOYSA-N 0 1 290.279 0.720 1 5 CCBFMN