BDBM79912 (4aS,8R,8aS)-2-(3,4-dichlorobenzyl)-1-keto-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide::(4aS,8R,8aS)-2-[(3,4-dichlorophenyl)methyl]-1-oxidanylidene-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide::(4aS,8R,8aS)-2-[(3,4-dichlorophenyl)methyl]-1-oxo-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide::MLS000882858::SMR000525469::cid_24747377

SMILES Clc1ccc(CN2CC[C@H]3C=CC[C@H]([C@H]3C2=O)C(=O)Nc2ccccc2)cc1Cl

InChI Key InChIKey=FOEVREDQDHWIBE-BLIXFSHQSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 79912   

TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79912((4aS,8R,8aS)-2-(3,4-dichlorobenzyl)-1-keto-N-pheny...)
Affinity DataIC50:  4.28E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79912((4aS,8R,8aS)-2-(3,4-dichlorobenzyl)-1-keto-N-pheny...)
Affinity DataIC50:  484nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay