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Ligand

NameCHEMBL557312
Molecular formulaC18H15N3O3S
IUPAC nameN-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Molecular weight353.396
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50414532
Inchi KeyBAIUZEKJBYRNJE-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H15N3O3S/c1-11-4-2-3-5-13(11)17-20-21-18(25-17)19-16(22)12-6-7-14-15(10-12)24-9-8-23-14/h2-7,10H,8-9H2,1H3,(H,19,21,22)
PubChem CID45273534
ChEMBLCHEMBL557312
IUPHARN/A
BindingDB50414532
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
18906Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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