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Ligand

NameCHEMBL3883621
Molecular formulaC24H23NO2S
IUPAC name5-[(5-naphthalen-2-yl-1-benzothiophen-2-yl)methylamino]pentanoic acid
Molecular weight389.513
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.2
SynonymsBDBM50209067
Inchi KeyBAJHFEOPASJFRJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23NO2S/c26-24(27)7-3-4-12-25-16-22-15-21-14-20(10-11-23(21)28-22)19-9-8-17-5-1-2-6-18(17)13-19/h1-2,5-6,8-11,13-15,25H,3-4,7,12,16H2,(H,26,27)
PubChem CID134131297
ChEMBLCHEMBL3883621
IUPHARN/A
BindingDB50209067
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548108Sphingosine 1-phosphate receptor 4O95977S1PR4Homo sapiens (Human)384
548107Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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