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Ligand

NameCHEMBL3359519
Molecular formulaC24H24F3NO4
IUPAC name2-[6-[[4-propan-2-yloxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetic acid
Molecular weight447.454
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.8
SynonymsBCGUKCVQRODEEB-UHFFFAOYSA-N
2-(7-(4-Isopropoxy-3-(trifluoromethyl)benzyloxy)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetic Acid
BDBM50041980
SCHEMBL2017679
Inchi KeyBCGUKCVQRODEEB-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24F3NO4/c1-14(2)32-22-6-3-15(9-19(22)24(25,26)27)13-31-18-4-5-20-17(10-18)11-21-16(12-23(29)30)7-8-28(20)21/h3-6,9-11,14,16H,7-8,12-13H2,1-2H3,(H,29,30)
PubChem CID58329611
ChEMBLCHEMBL3359519
IUPHARN/A
BindingDB50041980
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442459Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
442461Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
442457Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378
442460Sphingosine 1-phosphate receptor 4O95977S1PR4Homo sapiens (Human)384
442458Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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