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Ligand

NameCHEMBL1809037
Molecular formulaC31H34N4O4
IUPAC namepropan-2-yl 2-[(6aR,9R)-7-(phenylcarbamoyl)-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinolin-4-yl]acetate
Molecular weight526.637
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.6
SynonymsSCHEMBL3196760
BDBM50349671
Inchi KeyRNXRZAYVPFEIRJ-AJTFRIOCSA-N
Inchi IDInChI=1S/C31H34N4O4/c1-20(2)39-28(36)19-34-17-21-16-27-25(24-11-8-12-26(34)29(21)24)15-22(30(37)33-13-6-7-14-33)18-35(27)31(38)32-23-9-4-3-5-10-23/h3-5,8-12,15,17,20,22,27H,6-7,13-14,16,18-19H2,1-2H3,(H,32,38)/t22-,27-/m1/s1
PubChem CID56663561
ChEMBLCHEMBL1809037
IUPHARN/A
BindingDB50349671
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
300885C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
300886C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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