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Ligand

NameCHEMBL1809040
Molecular formulaC32H37N5O2
IUPAC name(6aR,9R)-N-phenyl-9-(pyrrolidine-1-carbonyl)-4-(2-pyrrolidin-1-ylethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-7-carboxamide
Molecular weight523.681
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.2
SynonymsBDBM50349674
Inchi KeyODGLLEQMXCBDJJ-FUFSCUOVSA-N
Inchi IDInChI=1S/C32H37N5O2/c38-31(35-15-6-7-16-35)24-19-27-26-11-8-12-28-30(26)23(21-36(28)18-17-34-13-4-5-14-34)20-29(27)37(22-24)32(39)33-25-9-2-1-3-10-25/h1-3,8-12,19,21,24,29H,4-7,13-18,20,22H2,(H,33,39)/t24-,29-/m1/s1
PubChem CID56673945
ChEMBLCHEMBL1809040
IUPHARN/A
BindingDB50349674
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
238381C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
238382C-X-C chemokine receptor type 3Q9JII9Cxcr3Rattus norvegicus (Rat)367
238383C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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