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Ligand

NameD0G8FF
Molecular formulaC22H17NO3S
IUPAC name2-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propylsulfanyl]benzaldehyde
Molecular weight375.442
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.2
SynonymsGTPL6580
2-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propylsulfanyl]benzaldehyde
Inchi KeyIYUOFUODBWFCBK-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H17NO3S/c24-14-16-6-1-2-11-19(16)27-13-5-12-23-21(25)17-9-3-7-15-8-4-10-18(20(15)17)22(23)26/h1-4,6-11,14H,5,12-13H2
PubChem CID73755227
ChEMBLN/A
IUPHAR6580
BindingDBN/A
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
554000Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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