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Ligand

NameMLS000070745
Molecular formulaC24H34N4O2
IUPAC name3-cyclohexyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidin-1-ylethyl)urea
Molecular weight410.562
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.2
SynonymsAKOS000773512
MLS002535548
3-cyclohexyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-1-(2-pyrrolidinoethyl)urea
ZINC8586274
3-cyclohexyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(1-pyrrolidinyl)ethyl]urea
[ Show all ]
Inchi KeyAFVNZFNIJYFCSZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H34N4O2/c1-18-8-7-9-19-16-20(23(29)26-22(18)19)17-28(15-14-27-12-5-6-13-27)24(30)25-21-10-3-2-4-11-21/h7-9,16,21H,2-6,10-15,17H2,1H3,(H,25,30)(H,26,29)
PubChem CID655059
ChEMBLCHEMBL1364079
IUPHARN/A
BindingDBN/A
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
4537Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
4536Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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