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Ligand

NameCHEMBL9367
Molecular formulaC18H21NOS
IUPAC name1-[[4-(4-methoxyphenyl)sulfanylphenyl]methyl]pyrrolidine
Molecular weight299.432
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.3
SynonymsPyrrolidine, 1-[[4-[(4-methoxyphenyl)thio]phenyl]methyl]-
BDBM50223846
CTK1J3004
SCHEMBL5789292
DTXSID40472247
[ Show all ]
Inchi KeyAZPDJWMBHFXOQQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H21NOS/c1-20-16-6-10-18(11-7-16)21-17-8-4-15(5-9-17)14-19-12-2-3-13-19/h4-11H,2-3,12-14H2,1H3
PubChem CID11771014
ChEMBLCHEMBL9367
IUPHARN/A
BindingDB50223846
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
18388Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386

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