compound 4a [Marquart et al., 1994]

Ligand id: 6707

Name: compound 4a [Marquart et al., 1994]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 23.47
Molecular weight 295.29
XLogP 6.22
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1R,7S,9aS)-7-decyl-octahydro-1H-quinolizin-1-ol
Database Links
ChEMBL Ligand CHEMBL277446
GtoPdb PubChem SID 178103318
PubChem CID 44275335
Search Google for chemical match using the InChIKey ASQOQJYHIYYTEJ-GBESFXJTSA-N
Search Google for chemicals with the same backbone ASQOQJYHIYYTEJ
Search UniChem for chemical match using the InChIKey ASQOQJYHIYYTEJ-GBESFXJTSA-N
Search UniChem for chemicals with the same backbone ASQOQJYHIYYTEJ