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Ligand

NameSCHEMBL3044904
Molecular formulaC19H21NO3
IUPAC name1-[(2-methyl-4-phenylmethoxyphenyl)methyl]azetidine-3-carboxylic acid
Molecular weight311.381
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP0.6
SynonymsCHEMBL3742033
Inchi KeyBUKCGZBYYUFUJB-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H21NO3/c1-14-9-18(23-13-15-5-3-2-4-6-15)8-7-16(14)10-20-11-17(12-20)19(21)22/h2-9,17H,10-13H2,1H3,(H,21,22)
PubChem CID59451750
ChEMBLCHEMBL3742033
IUPHARN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522543Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
522542Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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