cis-10 [PMID: 15771457]

Ligand id: 6474

Name: cis-10 [PMID: 15771457]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 48.42
Molecular weight 327.18
XLogP 3.83
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-ethyl-2-methoxy-6-{[(1s,4s)-4-methoxycyclohexyl]carbonyl}quinoline
Database Links
GtoPdb PubChem SID 178103088
PubChem CID 10245890
Search Google for chemical match using the InChIKey IOCYQQQCJYMWDT-KDYLLFBJSA-N
Search Google for chemicals with the same backbone IOCYQQQCJYMWDT
Search UniChem for chemical match using the InChIKey IOCYQQQCJYMWDT-KDYLLFBJSA-N
Search UniChem for chemicals with the same backbone IOCYQQQCJYMWDT
Comments
This ligand is represented in PubChem without chiral centres by CID 10245890.