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Ligand

NameFK-453
Molecular formulaC23H25N3O2
IUPAC name(E)-1-[(2R)-2-(2-hydroxyethyl)piperidin-1-yl]-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)prop-2-en-1-one
Molecular weight375.472
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.2
SynonymsGTPL5606
(E)-1-[(R)-2-(2-Hydroxy-ethyl)-piperidin-1-yl]-3-(2-phenyl-pyrazolo[1,5-a]pyridin-3-yl)-propenone
1-[2-(2-Hydroxy-ethyl)-piperidin-1-yl]-3-(2-phenyl-pyrazolo[1,5-a]pyridin-3-yl)-propenone
C23H25N3O2
FR 113453
[ Show all ]
Inchi KeyOPLOPFHUHFGKMJ-JXOMPUQVSA-N
Inchi IDInChI=1S/C23H25N3O2/c27-17-14-19-10-4-6-15-25(19)22(28)13-12-20-21-11-5-7-16-26(21)24-23(20)18-8-2-1-3-9-18/h1-3,5,7-9,11-13,16,19,27H,4,6,10,14-15,17H2/b13-12+/t19-/m1/s1
PubChem CID6439091
ChEMBLCHEMBL440115
IUPHAR5606
BindingDB50079652
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: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
247122Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
247123Adenosine receptor A1Q60612Adora1Mus musculus (Mouse)326
247125Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
247126Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326
247121Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
247127Adenosine receptor A2aP46616ADORA2ACavia porcellus (Guinea pig)409
247130Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410
247128Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
247129Adenosine receptor A2bP29276Adora2bRattus norvegicus (Rat)332
247124Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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