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Ligand

NameCHEMBL88160
Molecular formulaC26H34F3N7O2
IUPAC nameN,N,1,3-tetramethyl-4-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propylamino]pyrazolo[3,4-b]pyridine-5-carboxamide
Molecular weight533.6
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50408199
N,N,1,3-Tetramethyl-4-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazino]propylamino]-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
Inchi KeyBSUZYOKJXFBXNY-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H34F3N7O2/c1-18-22-23(19(25(37)33(2)3)16-31-24(22)34(4)32-18)30-10-7-11-35-12-14-36(15-13-35)20-8-5-6-9-21(20)38-17-26(27,28)29/h5-6,8-9,16H,7,10-15,17H2,1-4H3,(H,30,31)
PubChem CID9893282
ChEMBLCHEMBL88160
IUPHARN/A
BindingDB50408199
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
320305-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
32031Alpha-1A adrenergic receptorO02824ADRA1AOryctolagus cuniculus (Rabbit)466
32034Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561
32033Alpha-2B adrenergic receptorP19328Adra2bRattus norvegicus (Rat)453
32032D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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