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Ligand

NameCHEMBL3669096
Molecular formulaC23H22FN5O2
IUPAC nameN-[2-(4-fluorophenyl)ethyl]-4-methoxy-6-(8-methoxy-2-methylquinolin-5-yl)-1,3,5-triazin-2-amine
Molecular weight419.46
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM176647
US9115121, US9115121, 39
Inchi KeyADWNPCKKPAZCGE-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22FN5O2/c1-14-4-9-17-18(10-11-19(30-2)20(17)26-14)21-27-22(29-23(28-21)31-3)25-13-12-15-5-7-16(24)8-6-15/h4-11H,12-13H2,1-3H3,(H,25,27,28,29)
PubChem CID118986969
ChEMBLCHEMBL3669096
IUPHARN/A
BindingDB176647
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
459252Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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