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Ligand

NameCHEMBL2179673
Molecular formulaC27H29N3O3
IUPAC name2-[2-[4-[(2-methylpyrrolo[3,4-c]quinolin-4-yl)oxymethyl]piperidin-1-yl]ethyl]benzoic acid
Molecular weight443.547
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM50398970
Inchi KeyDAQIUCFPMNHHQR-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H29N3O3/c1-29-16-23-22-8-4-5-9-25(22)28-26(24(23)17-29)33-18-19-10-13-30(14-11-19)15-12-20-6-2-3-7-21(20)27(31)32/h2-9,16-17,19H,10-15,18H2,1H3,(H,31,32)
PubChem CID44628269
ChEMBLCHEMBL2179673
IUPHARN/A
BindingDB50398970
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
552435-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
552445-hydroxytryptamine receptor 4Q13639HTR4Homo sapiens (Human)388

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