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Ligand

NameCHEMBL479557
Molecular formulaC26H31N3O2
IUPAC name[3-[[2-(2,6-diethylphenyl)-4-methoxy-5,6,7,8-tetrahydroquinolin-5-yl]amino]pyridin-4-yl]methanol
Molecular weight417.553
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.0
SynonymsSCHEMBL13943975
(3-(2-(2,6-diethylphenyl)-4-methoxy-5,6,7,8-tetrahydroquinolin-5-ylamino)pyridin-4-yl)methanol
BDBM50251461
Inchi KeyAPBZRDZUJOBALE-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H31N3O2/c1-4-17-8-6-9-18(5-2)25(17)22-14-24(31-3)26-20(28-22)10-7-11-21(26)29-23-15-27-13-12-19(23)16-30/h6,8-9,12-15,21,29-30H,4-5,7,10-11,16H2,1-3H3
PubChem CID25191129
ChEMBLCHEMBL479557
IUPHARN/A
BindingDB50251461
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
10841C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350

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