BMS-345541

Ligand id: 5669

Name: BMS-345541

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 68.24
Molecular weight 255.15
XLogP 1.88
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(2-aminoethyl)-1,8-dimethylimidazo[1,2-a]quinoxalin-4-amine
Synonyms
BMS 345541 | BMS345541
Database Links
CAS Registry No. 547757-23-3
ChEMBL Ligand CHEMBL249697
GtoPdb PubChem SID 178102297
PubChem CID 9813758
Search Google for chemical match using the InChIKey PSPFQEBFYXJZEV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PSPFQEBFYXJZEV
Search UniChem for chemical match using the InChIKey PSPFQEBFYXJZEV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PSPFQEBFYXJZEV
Wikipedia BMS-345541
Comments
BMS-345541 is a selective allosteric inhibitor of both subunits (IKK-alpha and IKK-beta) of IκB kinase (IKK) [1]. Has anti-inflammatory activity.