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Ligand

NameCHEMBL1082711
Molecular formulaC26H33NO2
IUPAC name(2R)-1-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]-3-(1-phenylpropoxy)propan-2-ol
Molecular weight391.555
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP5.3
SynonymsSCHEMBL14502691
BDBM50319998
(2R)-1-(2-methyl-1-(naphthalen-2-yl)propan-2-ylamino)-3-(1-phenylpropoxy)propan-2-ol
Inchi KeyCJCVKAOQXCYZIS-IKOFQBKESA-N
Inchi IDInChI=1S/C26H33NO2/c1-4-25(22-11-6-5-7-12-22)29-19-24(28)18-27-26(2,3)17-20-14-15-21-10-8-9-13-23(21)16-20/h5-16,24-25,27-28H,4,17-19H2,1-3H3/t24-,25?/m1/s1
PubChem CID46891364
ChEMBLCHEMBL1082711
IUPHARN/A
BindingDB50319998
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
43226Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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