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Ligand

NameCHEMBL482155
Molecular formulaC23H22Cl2N2O4S2
IUPAC name(E)-3-[1-[(2,4-dichlorophenyl)methyl]-3a-methyl-2-oxo-3,4,5,6-tetrahydroindol-7-yl]-N-thiophen-2-ylsulfonylprop-2-enamide
Molecular weight525.459
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.5
SynonymsBDBM50255886
3-(1-(2,4-dichlorobenzyl)-3a-methyl-2-oxo-2,3,3a,4,5,6-hexahydro-1H-indol-7-yl)-N-(thiophen-2-ylsulfonyl)acrylamide
Inchi KeyATUKHMAXHQIDBP-VQHVLOKHSA-N
Inchi IDInChI=1S/C23H22Cl2N2O4S2/c1-23-10-2-4-15(7-9-19(28)26-33(30,31)21-5-3-11-32-21)22(23)27(20(29)13-23)14-16-6-8-17(24)12-18(16)25/h3,5-9,11-12H,2,4,10,13-14H2,1H3,(H,26,28)/b9-7+
PubChem CID44571318
ChEMBLCHEMBL482155
IUPHARN/A
BindingDB50255886
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14338Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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