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Ligand

NameCHEMBL520480
Molecular formulaC20H18Cl2N2O4S2
IUPAC name2-[5-(3,4-dichlorophenyl)sulfanyl-4-methylsulfonyl-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-6-yl]acetic acid
Molecular weight485.394
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50277988
SCHEMBL991162
(+/-)-2-(5-(3,4-dichlorophenylthio)-4-(methylsulfonyl)-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-6-yl)acetic acid
Inchi KeyANSZFKJHEBXZMZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18Cl2N2O4S2/c1-30(27,28)15-6-7-23-20-17(15)19(29-12-4-5-13(21)14(22)10-12)18-11(9-16(25)26)3-2-8-24(18)20/h4-7,10-11H,2-3,8-9H2,1H3,(H,25,26)
PubChem CID10254794
ChEMBLCHEMBL520480
IUPHARN/A
BindingDB50277988
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9849Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
9850Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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