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Ligand

NameMLS001116397
Molecular formulaC20H19ClN4O5S2
IUPAC name5-chloro-2-ethylsulfonyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]pyrimidine-4-carboxamide
Molecular weight494.965
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP2.6
Synonyms5-chloro-2-esyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]pyrimidine-4-carboxamide
cid_16012896
SMR000625584
MCULE-5762921859
MolPort-000-399-417
[ Show all ]
Inchi KeyBQRKTURWLVUUPM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19ClN4O5S2/c1-3-31(27,28)20-22-13-17(21)18(24-20)19(26)23-14-9-11-16(12-10-14)32(29,30)25(2)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,23,26)
PubChem CID16012896
ChEMBLCHEMBL1416089
IUPHARN/A
BindingDB54838
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: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
30587Apelin receptorP35414APLNRHomo sapiens (Human)380
30588Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
30589Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
30585Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
30586Lutropin-choriogonadotropic hormone receptorP22888LHCGRHomo sapiens (Human)699
30590Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
466664Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
30584Thyrotropin receptorP16473TSHRHomo sapiens (Human)764
30583Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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