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Ligand

NameCHEMBL1809004
Molecular formulaC26H27N5O2
IUPAC name(6aR,9R)-N-phenyl-9-(piperazine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight441.535
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP1.7
SynonymsBDBM50349645
Inchi KeyVWEZJTHPKBQXNE-WZONZLPQSA-N
Inchi IDInChI=1S/C26H27N5O2/c32-25(30-11-9-27-10-12-30)18-13-21-20-7-4-8-22-24(20)17(15-28-22)14-23(21)31(16-18)26(33)29-19-5-2-1-3-6-19/h1-8,13,15,18,23,27-28H,9-12,14,16H2,(H,29,33)/t18-,23-/m1/s1
PubChem CID56667005
ChEMBLCHEMBL1809004
IUPHARN/A
BindingDB50349645
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
365829C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
365830C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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