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Ligand

NameCHEMBL460680
Molecular formulaC22H33F2N7O4
IUPAC name2-[5-[(1R)-1-[(2-amino-2-methylpropanoyl)amino]-4,4-difluoro-4-phenylbutyl]tetrazol-1-yl]ethyl N-(4-hydroxybutyl)carbamate
Molecular weight497.548
Hydrogen bond acceptor10
Hydrogen bond donor4
XlogP1.0
SynonymsBDBM50243597
(R)-2-(5-(1-(2-amino-2-methylpropanamido)-4,4-difluoro-4-phenylbutyl)-1H-tetrazol-1-yl)ethyl 4-hydroxybutylcarbamate
Inchi KeyATQNZOMJKQGZHT-QGZVFWFLSA-N
Inchi IDInChI=1S/C22H33F2N7O4/c1-21(2,25)19(33)27-17(10-11-22(23,24)16-8-4-3-5-9-16)18-28-29-30-31(18)13-15-35-20(34)26-12-6-7-14-32/h3-5,8-9,17,32H,6-7,10-15,25H2,1-2H3,(H,26,34)(H,27,33)/t17-/m1/s1
PubChem CID24894012
ChEMBLCHEMBL460680
IUPHARN/A
BindingDB50243597
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
14258Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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