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Ligand

NameCHEMBL412831
Molecular formulaC23H22F3N3O
IUPAC name(E)-N-(4-amino-2-butan-2-ylquinolin-6-yl)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide
Molecular weight413.444
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.2
SynonymsBDBM50193645
SCHEMBL6223165
(E)-N-(4-amino-2-sec-butylquinolin-6-yl)-3-(4-(trifluoromethyl)phenyl)acrylamide
SCHEMBL6223169
Inchi KeyBLQVRMCVQJLLPJ-IZZDOVSWSA-N
Inchi IDInChI=1S/C23H22F3N3O/c1-3-14(2)21-13-19(27)18-12-17(9-10-20(18)29-21)28-22(30)11-6-15-4-7-16(8-5-15)23(24,25)26/h4-14H,3H2,1-2H3,(H2,27,29)(H,28,30)/b11-6+
PubChem CID44417966
ChEMBLCHEMBL412831
IUPHARN/A
BindingDB50193645
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
26898Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
26899Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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