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Ligand

NameCHEMBL481614
Molecular formulaC25H22Cl2F2N2O4S
IUPAC name(E)-N-(3,5-dichlorophenyl)sulfonyl-3-[1-[(3,4-difluorophenyl)methyl]-3a-methyl-2-oxo-3,4,5,6-tetrahydroindol-7-yl]prop-2-enamide
Molecular weight555.418
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50255286
N-(3,5-dichlorophenylsulfonyl)-3-(1-(3,4-difluorobenzyl)-3a-methyl-2-oxo-2,3,3a,4,5,6-hexahydro-1H-indol-7-yl)acrylamide
Inchi KeyAIEHEPFQGINRGI-FNORWQNLSA-N
Inchi IDInChI=1S/C25H22Cl2F2N2O4S/c1-25-8-2-3-16(5-7-22(32)30-36(34,35)19-11-17(26)10-18(27)12-19)24(25)31(23(33)13-25)14-15-4-6-20(28)21(29)9-15/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,30,32)/b7-5+
PubChem CID44570829
ChEMBLCHEMBL481614
IUPHARN/A
BindingDB50255286
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
6135Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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