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Ligand

NameCHEMBL3963788
Molecular formulaC17H16F2N4O3S2
IUPAC name5-amino-N-[[4-(difluoromethylsulfonyl)phenyl]methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
Molecular weight426.457
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP3.1
SynonymsKNZAIFIZJGFOCI-UHFFFAOYSA-N
5-amino-N-(4-((difluoromethyl)sulfonyl)benzyl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide
SCHEMBL15212221
BDBM50207463
Inchi KeyKNZAIFIZJGFOCI-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H16F2N4O3S2/c1-8-9(2)22-23-16-12(8)13(20)14(27-16)15(24)21-7-10-3-5-11(6-4-10)28(25,26)17(18)19/h3-6,17H,7,20H2,1-2H3,(H,21,24)
PubChem CID89768534
ChEMBLCHEMBL3963788
IUPHARN/A
BindingDB50207463
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: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
540451Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
540456Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
540452Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
540454Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
540450Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
540453Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
540449Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479
540455Muscarinic acetylcholine receptor M4P08485Chrm4Rattus norvegicus (Rat)478
540457Muscarinic acetylcholine receptor M5P08911Chrm5Rattus norvegicus (Rat)531
540458Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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