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Ligand

NameAC1OA8CK
Molecular formulaC25H25N3O2S
IUPAC name3-[(3,5-dimethylphenyl)carbamoyl]-6-ethyl-1-(4-methoxyphenyl)imidazo[1,2-a]pyridin-4-ium-2-thiolate
Molecular weight431.554
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.7
SynonymsMLS000517152
CHEMBL1519802
HMS2753G18
AKOS002528745
SMR000343312
[ Show all ]
Inchi KeyCFEBGEHJRYCBKB-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25N3O2S/c1-5-18-6-11-22-27(15-18)23(24(29)26-19-13-16(2)12-17(3)14-19)25(31)28(22)20-7-9-21(30-4)10-8-20/h6-15H,5H2,1-4H3,(H-,26,29,31)
PubChem CID6800739
ChEMBLCHEMBL1519802
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
40561Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
40559Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
40562Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
40560Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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