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Ligand

NameCHEMBL604277
Molecular formulaC26H28N2O4S2
IUPAC name4-methyl-N-[2-[(4-methylphenyl)sulfonyl-prop-2-enylamino]phenyl]-N-prop-2-enylbenzenesulfonamide
Molecular weight496.64
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP5.4
SynonymsAKOS024364667
ST50997002
N,N'-Diallyl-N,N'-ditosyl-1,2-benzenediamine
BDBM50305737
ZINC2573080
[ Show all ]
Inchi KeyWLHVFPKZYDQKGS-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28N2O4S2/c1-5-19-27(33(29,30)23-15-11-21(3)12-16-23)25-9-7-8-10-26(25)28(20-6-2)34(31,32)24-17-13-22(4)14-18-24/h5-18H,1-2,19-20H2,3-4H3
PubChem CID3453336
ChEMBLCHEMBL604277
IUPHARN/A
BindingDB50305737
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
376191C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
376190C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352
376188C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350
376192C5a anaphylatoxin chemotactic receptor 1P97520C5ar1Rattus norvegicus (Rat)352
376189P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377

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