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Ligand

NameCHEMBL1809011
Molecular formulaC27H28N4O3
IUPAC name(6aR,9R)-9-(4-hydroxypiperidine-1-carbonyl)-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight456.546
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP2.2
SynonymsBDBM50349652
Inchi KeyCAOVBFVVCXSCPJ-HOYKHHGWSA-N
Inchi IDInChI=1S/C27H28N4O3/c32-20-9-11-30(12-10-20)26(33)18-13-22-21-7-4-8-23-25(21)17(15-28-23)14-24(22)31(16-18)27(34)29-19-5-2-1-3-6-19/h1-8,13,15,18,20,24,28,32H,9-12,14,16H2,(H,29,34)/t18-,24-/m1/s1
PubChem CID56670448
ChEMBLCHEMBL1809011
IUPHARN/A
BindingDB50349652
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
37400C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
37401C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
37402C-X-C chemokine receptor type 3Q9JII9Cxcr3Rattus norvegicus (Rat)367

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