BDBM50652385 CHEMBL5646768

SMILES C=CC(=O)Nc1cccc(c1)CCOc2cc(ccc2Oc3cc(cc(c3)Cl)C#N)Cl

InChI Key InChIKey=JKEJVDFTNRUUBQ-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

  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 = 50652385   

TargetReverse transcriptase/RNaseH(Human immunodeficiency virus type 1)
Yale University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50652385BDBM50652385(CHEMBL5646768)
Affinity DataIC50: 60nMAssay Description:Inhibition of HIV1 reverse transcriptase using r(A)350 template and d(T)16 primer as substrate preincubated for 1 hr before adding substrate by PicoG...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMedPDB3D3D Structure (crystal)