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Ligand

NameSCHEMBL3308583
Molecular formulaC22H22N2O4
IUPAC name5-cyano-2-[(3-methyl-2-propan-2-yloxybenzoyl)amino]-1,3-dihydroindene-2-carboxylic acid
Molecular weight378.428
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.5
SynonymsCHEMBL3716430
Inchi KeySCTROFAFVZDPGV-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22N2O4/c1-13(2)28-19-14(3)5-4-6-18(19)20(25)24-22(21(26)27)10-16-8-7-15(12-23)9-17(16)11-22/h4-9,13H,10-11H2,1-3H3,(H,24,25)(H,26,27)
PubChem CID59314103
ChEMBLCHEMBL3716430
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
530257C-X-C chemokine receptor type 5P32302CXCR5Homo sapiens (Human)372

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