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Ligand

NameCHEMBL117288
Molecular formulaC17H20ClN5O
IUPAC name2-[3-[2-(3-chloroanilino)ethylamino]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
Molecular weight345.831
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.5
Synonyms2-[3-[2-(3-Chloroanilino)ethylamino]propyl]-1,2,4-triazolo[4,3-a]pyridine-3(2H)-one
Inchi KeySGXXTUPUUQQXFD-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H20ClN5O/c18-14-5-3-6-15(13-14)20-10-9-19-8-4-12-23-17(24)22-11-2-1-7-16(22)21-23/h1-3,5-7,11,13,19-20H,4,8-10,12H2
PubChem CID10807497
ChEMBLCHEMBL117288
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
3140775-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
314076D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
454164Histamine H1 receptorP30546HRH1Bos taurus (Bovine)491

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