264W94

Ligand id: 6529

Name: 264W94

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 73.01
Molecular weight 417.2
XLogP 5.76
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R,5R)-3-butyl-3-ethyl-7,8-dimethoxy-5-phenyl-4,5-dihydro-2H-benzo[f][1,4]thiazepine 1,1-dioxide
Database Links
ChEMBL Ligand CHEMBL332370
PubChem CID 9823277
Search Google for chemical match using the InChIKey CKFWDLFFXXVSBJ-DHIUTWEWSA-N
Search Google for chemicals with the same backbone CKFWDLFFXXVSBJ
Search UniChem for chemical match using the InChIKey CKFWDLFFXXVSBJ-DHIUTWEWSA-N
Search UniChem for chemicals with the same backbone CKFWDLFFXXVSBJ