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Ligand

NameSMR000196675
Molecular formulaC22H24N2O2S2
IUPAC name2-(1,3-benzothiazol-2-ylsulfanyl)-1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)ethanone
Molecular weight412.566
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.6
Synonyms1-[(1,3-benzothiazol-2-ylthio)acetyl]-6-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline
2-(1,3-benzothiazol-2-ylsulfanyl)-1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)ethanone
2-(1,3-benzothiazol-2-ylsulfanyl)-1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)ethanone
2-(1,3-benzothiazol-2-ylthio)-1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)ethanone
AC1MFGGF
[ Show all ]
Inchi KeyAFXLHBRQFXVKKF-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N2O2S2/c1-14-12-22(2,3)24(18-10-9-15(26-4)11-16(14)18)20(25)13-27-21-23-17-7-5-6-8-19(17)28-21/h5-11,14H,12-13H2,1-4H3
PubChem CID2918857
ChEMBLCHEMBL1544798
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4591Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
4592Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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