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Ligand

NameCHEMBL1809038
Molecular formulaC28H30N4O3
IUPAC name(6aR,9R)-4-(2-hydroxyethyl)-N-phenyl-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-7-carboxamide
Molecular weight470.573
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.0
SynonymsSCHEMBL3186733
BDBM50349672
Inchi KeyJLYWDONWNIMGQM-CJFMBICVSA-N
Inchi IDInChI=1S/C28H30N4O3/c33-14-13-31-17-19-16-25-23(22-9-6-10-24(31)26(19)22)15-20(27(34)30-11-4-5-12-30)18-32(25)28(35)29-21-7-2-1-3-8-21/h1-3,6-10,15,17,20,25,33H,4-5,11-14,16,18H2,(H,29,35)/t20-,25-/m1/s1
PubChem CID56680574
ChEMBLCHEMBL1809038
IUPHARN/A
BindingDB50349672
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
154154C-X-C chemokine receptor type 3Q9JII9Cxcr3Rattus norvegicus (Rat)367
154155C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
154156C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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