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Ligand

NameCHEMBL1808997
Molecular formulaC28H32N4O4
IUPAC name(6aR,9R)-9-N,9-N-bis(2-methoxyethyl)-7-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7,9-dicarboxamide
Molecular weight488.588
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.0
SynonymsBDBM50349639
Inchi KeyZWQFKHFUOPFJAH-CJFMBICVSA-N
Inchi IDInChI=1S/C28H32N4O4/c1-35-13-11-31(12-14-36-2)27(33)20-15-23-22-9-6-10-24-26(22)19(17-29-24)16-25(23)32(18-20)28(34)30-21-7-4-3-5-8-21/h3-10,15,17,20,25,29H,11-14,16,18H2,1-2H3,(H,30,34)/t20-,25-/m1/s1
PubChem CID56660098
ChEMBLCHEMBL1808997
IUPHARN/A
BindingDB50349639
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
439341C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
439342C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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