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Ligand

NameCGP 20712A
Molecular formulaC23H25F3N4O5
IUPAC name2-hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide
Molecular weight494.471
Hydrogen bond acceptor10
Hydrogen bond donor4
XlogP2.3
Synonyms1-[2-(3-carbamoyl-4-hydroxyphenoxy)-ethylamino]-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]-phenoxy]-2-propanol
C23H25F3N4O5
CGP-20712A
D03JHA
NCGC00024944-03
[ Show all ]
Inchi KeyGKJZEKSHCJELPL-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25F3N4O5/c1-30-12-20(23(24,25)26)29-22(30)14-2-4-16(5-3-14)35-13-15(31)11-28-8-9-34-17-6-7-19(32)18(10-17)21(27)33/h2-7,10,12,15,28,31-32H,8-9,11,13H2,1H3,(H2,27,33)
PubChem CID2685
ChEMBLCHEMBL280822
IUPHAR541
BindingDB25746
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: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
987285-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
987295-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
987255-hydroxytryptamine receptor 2AP35363Htr2aMus musculus (Mouse)471
98722Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
98727Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
98724Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
98723Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408
98726Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400

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