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Ligand

NameCHEMBL1809027
Molecular formulaC25H30N4O2
IUPAC name(6aR,9R)-N-cyclopentyl-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
Molecular weight418.541
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP2.5
SynonymsBDBM50349684
Inchi KeyWTAYQRJTVWIWEB-VGOFRKELSA-N
Inchi IDInChI=1S/C25H30N4O2/c30-24(28-10-3-4-11-28)17-12-20-19-8-5-9-21-23(19)16(14-26-21)13-22(20)29(15-17)25(31)27-18-6-1-2-7-18/h5,8-9,12,14,17-18,22,26H,1-4,6-7,10-11,13,15H2,(H,27,31)/t17-,22-/m1/s1
PubChem CID56673941
ChEMBLCHEMBL1809027
IUPHARN/A
BindingDB50349684
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
381737C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
381738C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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