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Ligand

NameCHEMBL1809006
Molecular formulaC27H29N5O2
IUPAC name(6aR,9R)-9-(4-methylpiperazine-1-carbonyl)-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight455.562
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.2
SynonymsBDBM50349647
Inchi KeyCVGQIJAZGUTYJV-NTKDMRAZSA-N
Inchi IDInChI=1S/C27H29N5O2/c1-30-10-12-31(13-11-30)26(33)19-14-22-21-8-5-9-23-25(21)18(16-28-23)15-24(22)32(17-19)27(34)29-20-6-3-2-4-7-20/h2-9,14,16,19,24,28H,10-13,15,17H2,1H3,(H,29,34)/t19-,24-/m1/s1
PubChem CID56673938
ChEMBLCHEMBL1809006
IUPHARN/A
BindingDB50349647
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
51436C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
51437C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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