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 Google for chemical match using the InChIKey NJXZWIIMWNEOGJ-WEWKHQNJSA-N
Search Google for chemicals with the same backbone NJXZWIIMWNEOGJ
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Wikipedia Nelivaptan
ZINC ZINC42833251

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