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Ligand

NameSCHEMBL13018946
Molecular formulaC34H39N7O3
IUPAC nameN-[(1R)-1-[4-[(2,4-dimethoxyphenyl)methyl]-5-(2-phenylethyl)-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]piperazine-2-carboxamide
Molecular weight593.732
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP3.5
SynonymsBDBM19347
Trisubstituted 1,2,4-Triazole, 55
N-[(1R)-1-{4-[(2,4-dimethoxyphenyl)methyl]-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl}-2-(1H-indol-3-yl)ethyl]piperazine-2-carboxamide
Inchi KeyAHJZFOKHUIPNSR-IDCGIGBZSA-N
Inchi IDInChI=1S/C34H39N7O3/c1-43-26-14-13-24(31(19-26)44-2)22-41-32(15-12-23-8-4-3-5-9-23)39-40-33(41)29(38-34(42)30-21-35-16-17-36-30)18-25-20-37-28-11-7-6-10-27(25)28/h3-11,13-14,19-20,29-30,35-37H,12,15-18,21-22H2,1-2H3,(H,38,42)/t29-,30?/m1/s1
PubChem CID23648256
ChEMBLN/A
IUPHARN/A
BindingDB19347
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5639Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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