(+)-cyclazosin

Ligand id: 486

Name: (+)-cyclazosin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 106.95
Molecular weight 437.21
XLogP 2.01
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(4aR,8aS)-4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-2,3,4a,5,6,7,8,8a-octahydroquinoxalin-1-yl]-furan-2-ylmethanone
Database Links
BindingDB Ligand 50122826
CAS Registry No. 139953-73-4 (source: Scifinder)
ChEBI CHEBI:63937
ChEMBL Ligand CHEMBL423294
PubChem CID 132266
Search Google for chemical match using the InChIKey XBRXTUGRUXGBPX-DLBZAZTESA-N
Search Google for chemicals with the same backbone XBRXTUGRUXGBPX
Search UniChem for chemical match using the InChIKey XBRXTUGRUXGBPX-DLBZAZTESA-N
Search UniChem for chemicals with the same backbone XBRXTUGRUXGBPX
Comments
Note that the chemical structure in the ChEMBL record accessed via the link above, is the non-chiral molecule.