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Ligand

NameCHEMBL121943
Molecular formulaC22H22F3N5O3
IUPAC name[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-[2-(trifluoromethyl)phenyl]methanone
Molecular weight461.445
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP3.5
SynonymsN/A
Inchi KeyCTKIHMWDMFAPKL-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22F3N5O3/c1-32-17-11-14-16(12-18(17)33-2)27-21(28-19(14)26)30-9-7-29(8-10-30)20(31)13-5-3-4-6-15(13)22(23,24)25/h3-6,11-12H,7-10H2,1-2H3,(H2,26,27,28)
PubChem CID10647689
ChEMBLCHEMBL121943
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
50173Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
50172Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
50174Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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