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Ligand

NameCHEMBL564190
Molecular formulaC20H19N3O3S
IUPAC nameN-[5-(2,4,6-trimethylphenyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Molecular weight381.45
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM50414534
Inchi KeyBXLHNELWHZXRDU-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19N3O3S/c1-11-8-12(2)17(13(3)9-11)19-22-23-20(27-19)21-18(24)14-4-5-15-16(10-14)26-7-6-25-15/h4-5,8-10H,6-7H2,1-3H3,(H,21,23,24)
PubChem CID45269223
ChEMBLCHEMBL564190
IUPHARN/A
BindingDB50414534
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35189Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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