AQ-RA 741

Ligand id: 8584

Name: AQ-RA 741

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 68.78
Molecular weight 463.29
XLogP 4.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
11-[2-[4-(4-diethylaminobutyl)piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Database Links
CAS Registry No. 123548-16-3 (source: Scifinder)
ChEMBL Ligand CHEMBL43383
GtoPdb PubChem SID 252166785
PubChem CID 129989
Search Google for chemical match using the InChIKey BCUGCHZRMKTPMU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BCUGCHZRMKTPMU
Search UniChem for chemical match using the InChIKey BCUGCHZRMKTPMU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BCUGCHZRMKTPMU