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Ligand

NameCHEMBL2059513
Molecular formulaC27H32N4O3
IUPAC nameN-[3-[(1R)-1-(2-acetamidoethylamino)ethyl]-8-methylquinolin-7-yl]-4-(cyclopropylmethoxy)benzamide
Molecular weight460.578
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP3.2
Synonymscompound (R)-10h
GTPL7754
compound (R)-10h [PMID: 22490048]
N-[3-[(1R)-1-[[2-(Acetylamino)ethyl]amino]ethyl]-8-methyl-7-quinolinyl]-4-(cyclopropylmethoxy)benzamide
4-(cyclopropylmethoxy)-N-{3-[(1R)-1-[(2-acetamidoethyl)amino]ethyl]-8-methylquinolin-7-yl}benzamide
[ Show all ]
Inchi KeyHRYQXLHGNOJEHH-GOSISDBHSA-N
Inchi IDInChI=1S/C27H32N4O3/c1-17-25(31-27(33)21-6-9-24(10-7-21)34-16-20-4-5-20)11-8-22-14-23(15-30-26(17)22)18(2)28-12-13-29-19(3)32/h6-11,14-15,18,20,28H,4-5,12-13,16H2,1-3H3,(H,29,32)(H,31,33)/t18-/m1/s1
PubChem CID57523087
ChEMBLCHEMBL2059513
IUPHAR7754
BindingDB50388460
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
122538Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
122539Melanin-concentrating hormone receptor 1P97639Mchr1Rattus norvegicus (Rat)353

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