IUPHAR DATABASE | LIGAND SUMMARY

Ligand Id: 2202
Ligand name	SSR149415

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

Summary Biological activity References Structure Similar ligands Radio analogues

Classification
Compound class	Synthetic organic

IUPAC Name

(2S,4R)-1-[(3R)-5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxoindol-3-yl]-4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide

International Nonproprietary Names
INN number	INN
8903	nelivaptan

Synonyms

(2S,4R)-1-[5-chloro-1-[(2,4-dimethoxyphenyl)sulfonyl]-3-(2-methoxy-phenyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]-4-hydroxy-N,N-dimethyl-2-pyrrolidine carboxamide

(2S,4R)-1-[(3R)-5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-met hoxyphenyl)-2-oxo-indolin-3-yl]-4-hydroxy-N,N-dimethyl-pyrrolidin e-2-carboxamide

(2S,4R)-1-[5-chloro-1-[(2,4-dimethoxyphenyl)sulfonyl]-3-(2-methoxy-phenyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]-4-hydroxy-N,N-dimethyl-2-pyrrolidine carboxamide

nelivaptan

SSR-149,415

Database Links
BindingDB Ligand	50299343
ChEMBL Ligand	672209
PubChem CID	9895468
Search on ChemSpider	NJXZWIIMWNEOGJ-WEWKHQNJSA-N
Wikipedia	Nelivaptan
ZINC	ZINC42833251

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org