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Ligand

NameCHEMBL565988
Molecular formulaC24H22N2O3S2
IUPAC name(E)-3-[1-[(3,4-dimethylphenyl)methyl]indol-7-yl]-N-thiophen-2-ylsulfonylprop-2-enamide
Molecular weight450.571
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50303692
Thiophene-2-sulfonic Acid{(E)-3-[1-(3,4-Dimethylbenzyl)-1H-indol-7-y l]acryloyl}amide
Inchi KeyBMDNYIKPUSORHV-ZHACJKMWSA-N
Inchi IDInChI=1S/C24H22N2O3S2/c1-17-8-9-19(15-18(17)2)16-26-13-12-21-6-3-5-20(24(21)26)10-11-22(27)25-31(28,29)23-7-4-14-30-23/h3-15H,16H2,1-2H3,(H,25,27)/b11-10+
PubChem CID44626880
ChEMBLCHEMBL565988
IUPHARN/A
BindingDB50303692
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
27375Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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