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Ligand

NameCHEMBL399651
Molecular formulaC35H33N5O3
IUPAC nameN-[(R)-[4-[(2,4-dimethoxyphenyl)methyl]-5-(2-phenylethyl)-1,2,4-triazol-3-yl]-(1H-indol-3-yl)methyl]benzamide
Molecular weight571.681
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.8
SynonymsBDBM50232263
(R)-N-((4-(2,4-dimethoxybenzyl)-5-phenethyl-4H-1,2,4-triazol-3-yl)(1H-indol-3-yl)methyl)benzamide
Inchi KeyAJMNYVOTXIKAAT-MGBGTMOVSA-N
Inchi IDInChI=1S/C35H33N5O3/c1-42-27-19-18-26(31(21-27)43-2)23-40-32(20-17-24-11-5-3-6-12-24)38-39-34(40)33(37-35(41)25-13-7-4-8-14-25)29-22-36-30-16-10-9-15-28(29)30/h3-16,18-19,21-22,33,36H,17,20,23H2,1-2H3,(H,37,41)/t33-/m1/s1
PubChem CID44445620
ChEMBLCHEMBL399651
IUPHARN/A
BindingDB50232263
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7040Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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