[3H]nelivaptan

Ligand id: 3483

Name: [3H]nelivaptan    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 134.3
Molecular weight 629.16
XLogP 2.57
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S,4R)-1-[(3R)-1-[2,4-bis(tritritiomethoxy)phenyl]sulfonyl-5-chloro-3-(2-methoxyphenyl)-2-oxoindol-3-yl]-4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
Synonyms
[3H]-SSR149415 | [3H]SSR149415
Database Links
ChEMBL Ligand CHEMBL2067983
PubChem CID 70692936
Search Google for chemical match using the InChIKey NJXZWIIMWNEOGJ-KGKCFUOPSA-N
Search Google for chemicals with the same backbone NJXZWIIMWNEOGJ
Search UniChem for chemical match using the InChIKey NJXZWIIMWNEOGJ-KGKCFUOPSA-N
Search UniChem for chemicals with the same backbone NJXZWIIMWNEOGJ