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Ligand

NameMLS000040640
Molecular formulaC18H25N5O2
IUPAC nameethyl 4-(cyclohexylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate
Molecular weight343.431
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.2
SynonymsAKOS022108431
HMS2386O13
SMR000042884
MCULE-5156124346
909861-07-0
[ Show all ]
Inchi KeyCHDHJASAMSWOTG-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25N5O2/c1-4-25-17(24)15-11-19-18(23-13(3)10-12(2)22-23)21-16(15)20-14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3,(H,19,20,21)
PubChem CID662276
ChEMBLCHEMBL1422386
IUPHARN/A
BindingDB36917
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
41874Galanin receptor type 3O60755GALR3Homo sapiens (Human)368
41871Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
459589Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
41875Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
41872Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
41873Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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