relcovaptan

Ligand id: 2200

Name: relcovaptan

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 147.85
Molecular weight 619.09
XLogP 3.54
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-1-[(2R,3S)-5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy2H-indole-2-carbonyl]pyrrolidine-2-carboxamide
International Nonproprietary Names
INN number INN
7809 relcovaptan
Synonyms
SR 49059 | SR-49059 | SR49059
Database Links
BindingDB Ligand 50114031
CAS Registry No. 150375-75-0 (source: Scifinder)
ChEMBL Ligand CHEMBL419667
PubChem CID 60943
Search Google for chemical match using the InChIKey CEBYCSRFKCEUSW-NAYZPBBASA-N
Search Google for chemicals with the same backbone CEBYCSRFKCEUSW
Search PubMed clinical trials relcovaptan
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Search UniChem for chemical match using the InChIKey CEBYCSRFKCEUSW-NAYZPBBASA-N
Search UniChem for chemicals with the same backbone CEBYCSRFKCEUSW
Wikipedia Relcovaptan