BI-9564

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Ligands
BI-9564

Ligand id: 8950

Name: BI-9564

Structure and Physico-chemical Properties

2D Structure

Calculated Physico-chemical Properties
Hydrogen bond acceptors	4
Hydrogen bond donors	0
Rotatable bonds	5
Topological polar surface area	54.9
Molecular weight	353.17
XLogP	1.27
No. Lipinski's rules broken	0

Molecular properties generated using the CDK

Classification
Compound class	Synthetic organic

IUPAC Name
4-{4-[(dimethylamino)methyl]-2,5-dimethoxyphenyl}-2-methyl-1,2-dihydro-2,7-naphthyridin-1-one

IUPAC Name

4-{4-[(dimethylamino)methyl]-2,5-dimethoxyphenyl}-2-methyl-1,2-dihydro-2,7-naphthyridin-1-one

Database Links
GtoPdb PubChem SID	310264731
PubChem CID	117072549
RCSB PDB Ligand	5U6
Search Google for chemical match using the InChIKey	BJFSUDWKXGMUKA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone	BJFSUDWKXGMUKA
Search UniChem for chemical match using the InChIKey	BJFSUDWKXGMUKA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone	BJFSUDWKXGMUKA
SynPHARM	83214 (in complex with bromodomain containing 9)

Comments
BI-9564 is an inhibitor of bromodomains in BRD7 and BRD9 [1-2]. BI-9564 is one of the compounds available from the Structural Genomics Consortium's epigenetic probes set. It was developed in collaboration with Boehringer Ingelheim.

Comments

BI-9564 is an inhibitor of bromodomains in BRD7 and BRD9 [1-2]. BI-9564 is one of the compounds available from the Structural Genomics Consortium's epigenetic probes set. It was developed in collaboration with Boehringer Ingelheim.