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Ligand

NameJTE 907
Molecular formulaC24H26N2O6
IUPAC nameN-(1,3-benzodioxol-5-ylmethyl)-7-methoxy-2-oxo-8-pentoxy-1H-quinoline-3-carboxamide
Molecular weight438.48
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
Synonyms3-Quinolinecarboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1,2-dihydro-7-methoxy-2-oxo-8-(pentyloxy)-
CHEBI:93098
N-(1,3-Benzodioxole-5-ylmethyl)-2-oxo-7-methoxy-8-pentoxy-1,2-dihydro-3-quinolinecarboxamide
PDSP2_000758
AKOS024457125
[ Show all ]
Inchi KeyGRAJFFFXJYFVOC-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26N2O6/c1-3-4-5-10-30-22-19(29-2)9-7-16-12-17(24(28)26-21(16)22)23(27)25-13-15-6-8-18-20(11-15)32-14-31-18/h6-9,11-12H,3-5,10,13-14H2,1-2H3,(H,25,27)(H,26,28)
PubChem CID9867770
ChEMBLCHEMBL178372
IUPHARN/A
BindingDB85739
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
103183Cannabinoid receptor 1P47746Cnr1Mus musculus (Mouse)473
103184Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
103186Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
103182Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
103185Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347
555865Cannabinoid receptor 2Q9QZN9Cnr2Rattus norvegicus (Rat)360

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