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Ligand

NameSCHEMBL1187087
Molecular formulaC27H35N5O5
IUPAC nameN-[(2S)-3-[2-ethyl-4-[5-(5-ethyl-6-pyrrolidin-1-ylpyridin-3-yl)-1,2,4-oxadiazol-3-yl]-6-methylphenoxy]-2-hydroxypropyl]-2-hydroxyacetamide
Molecular weight509.607
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP3.3
SynonymsCHEMBL3126610
Inchi KeyASDGDYJTNXVUCK-QFIPXVFZSA-N
Inchi IDInChI=1S/C27H35N5O5/c1-4-18-11-20(10-17(3)24(18)36-16-22(34)14-28-23(35)15-33)25-30-27(37-31-25)21-12-19(5-2)26(29-13-21)32-8-6-7-9-32/h10-13,22,33-34H,4-9,14-16H2,1-3H3,(H,28,35)/t22-/m0/s1
PubChem CID44218903
ChEMBLCHEMBL3126610
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13017Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
13018Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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