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Ligand

NameCHEMBL595990
Molecular formulaC22H24N2O4S2
IUPAC nameN,4-dimethyl-N-[2-[methyl-(4-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
Molecular weight444.564
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.1
SynonymsAC1Q6V82
methyl(2-{methyl[(4-methylphenyl)sulfonyl]amino}phenyl)[(4-methylphenyl)sulfon yl]amine
NSC-101062
p-Toluenesulfonamide,N'-o-phenylenebis[N-methyl-
CBDivE_001423
[ Show all ]
Inchi KeyWOBGBOUAUABUFZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N2O4S2/c1-17-9-13-19(14-10-17)29(25,26)23(3)21-7-5-6-8-22(21)24(4)30(27,28)20-15-11-18(2)12-16-20/h5-16H,1-4H3
PubChem CID265219
ChEMBLCHEMBL595990
IUPHARN/A
BindingDB50305735
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
378170C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
378173C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352
378169C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350
378171C5a anaphylatoxin chemotactic receptor 1P97520C5ar1Rattus norvegicus (Rat)352
378172P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377

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