BDBM50643509 CHEMBL5572774

SMILES COC[C@@H](COCCC(=O)N1CCN2c3ncc(C(F)(F)F)cc3COC[C@H]2C1)Oc1cn[nH]c(=O)c1C(F)(F)F

InChI Key InChIKey=NESGTHMMTPBCAG-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50643509   

TargetProtein mono-ADP-ribosyltransferase TIPARP(Human)
Hubei Polytechnic University

Curated by ChEMBL
LigandPNGBDBM50643509(CHEMBL5572774)
Affinity DataIC50: 5.70nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed