BRD4770

Ligand id: 7016

Name: BRD4770

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 73.22
Molecular weight 413.17
XLogP 8.23
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl 2-benzamido-1-(3-phenylpropyl)benzimidazole-5-carboxylate
Synonyms
BRD 4770 | BRD-4770
Database Links
CAS Registry No. 1374601-40-7 (source: Scifinder)
PubChem CID 72193870
Search Google for chemical match using the InChIKey UCGWYCMPZXDHNR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone UCGWYCMPZXDHNR
Search UniChem for chemical match using the InChIKey UCGWYCMPZXDHNR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone UCGWYCMPZXDHNR
Comments
BRD4770 may be hydrolysed to BRD9539 (see [2]) in cells, with the latter being the more active compound.