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Ligand

NameCHEMBL1809039
Molecular formulaC30H35N5O2
IUPAC name(6aR,9R)-4-[2-(dimethylamino)ethyl]-N-phenyl-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-7-carboxamide
Molecular weight497.643
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.8
SynonymsBDBM50349673
Inchi KeyAXRCXUFFPRZXER-AJTFRIOCSA-N
Inchi IDInChI=1S/C30H35N5O2/c1-32(2)15-16-34-19-21-18-27-25(24-11-8-12-26(34)28(21)24)17-22(29(36)33-13-6-7-14-33)20-35(27)30(37)31-23-9-4-3-5-10-23/h3-5,8-12,17,19,22,27H,6-7,13-16,18,20H2,1-2H3,(H,31,37)/t22-,27-/m1/s1
PubChem CID56673944
ChEMBLCHEMBL1809039
IUPHARN/A
BindingDB50349673
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16999C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
17000C-X-C chemokine receptor type 3Q9JII9Cxcr3Rattus norvegicus (Rat)367
17001C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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