FR191413

Ligand id: 669

Name: FR191413

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 2
Rotatable bonds 15
Topological polar surface area 140.57
Molecular weight 687.18
XLogP 4.9
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(E)-3-(6-acetamidopyridin-3-yl)-N-[2-[[2,4-dichloro-3-[[2-methoxy-1-(pyridin-2-ylmethyl)benzimidazol-4-yl]oxymethyl]phenyl]-methylamino]-2-oxoethyl]prop-2-enamide
Synonyms
FR 191413 | FR-191413
Database Links
BindingDB Ligand 50146892
ChEMBL Ligand CHEMBL329762
PubChem CID 10394861
Search Google for chemical match using the InChIKey KXMCFJQQOFOBKN-RVDMUPIBSA-N
Search Google for chemicals with the same backbone KXMCFJQQOFOBKN
Search UniChem for chemical match using the InChIKey KXMCFJQQOFOBKN-RVDMUPIBSA-N
Search UniChem for chemicals with the same backbone KXMCFJQQOFOBKN