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Ligand

NameCHEMBL1809016
Molecular formulaC26H25FN4O2
IUPAC name(6aR,9R)-N-(3-fluorophenyl)-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight444.51
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.9
SynonymsBDBM50349656
Inchi KeyYGPFKAKIRJHMEB-UZUQRXQVSA-N
Inchi IDInChI=1S/C26H25FN4O2/c27-18-5-3-6-19(13-18)29-26(33)31-15-17(25(32)30-9-1-2-10-30)11-21-20-7-4-8-22-24(20)16(14-28-22)12-23(21)31/h3-8,11,13-14,17,23,28H,1-2,9-10,12,15H2,(H,29,33)/t17-,23-/m1/s1
PubChem CID56663560
ChEMBLCHEMBL1809016
IUPHARN/A
BindingDB50349656
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
409690C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
409691C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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