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Ligand

NameCHEMBL372721
Molecular formulaC26H28Cl2N4O
IUPAC name1-[(1S,2R,5S)-5-(4-cyanophenyl)-2-bicyclo[3.1.0]hexanyl]-3-(3,5-dichlorophenyl)-1-(2-pyrrolidin-1-ylethyl)urea
Molecular weight483.437
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.3
SynonymsBDBM50164245
1-[(1S,2R,5S)-5-(4-Cyano-phenyl)-bicyclo[3.1.0]hex-2-yl]-3-(3,5-dichloro-phenyl)-1-(2-pyrrolidin-1-yl-ethyl)-urea
Inchi KeyBJNIDUIQWUGXOW-DGWZTRNLSA-N
Inchi IDInChI=1S/C26H28Cl2N4O/c27-20-13-21(28)15-22(14-20)30-25(33)32(12-11-31-9-1-2-10-31)24-7-8-26(16-23(24)26)19-5-3-18(17-29)4-6-19/h3-6,13-15,23-24H,1-2,7-12,16H2,(H,30,33)/t23-,24-,26-/m1/s1
PubChem CID10195667
ChEMBLCHEMBL372721
IUPHARN/A
BindingDB50164245
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
25300Melanin-concentrating hormone receptor 1Q8JZL2Mchr1Mus musculus (Mouse)353
25301Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
25299Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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