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Ligand

NameCHEMBL1096802
Molecular formulaC29H33N5O
IUPAC name6-methoxy-8-[4-[1-(2-methylquinolin-8-yl)piperidin-4-yl]piperazin-1-yl]quinoline
Molecular weight467.617
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP5.1
SynonymsSCHEMBL3563964
BDBM50316688
8-{4-[4-(6-Methoxyquinolin-8-yl)piperazin-1-yl]piperidin-1-yl}-2-methylquinoline
Inchi KeyAGKQMEJGGYUHPL-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H33N5O/c1-21-8-9-22-5-3-7-26(29(22)31-21)33-13-10-24(11-14-33)32-15-17-34(18-16-32)27-20-25(35-2)19-23-6-4-12-30-28(23)27/h3-9,12,19-20,24H,10-11,13-18H2,1-2H3
PubChem CID12004197
ChEMBLCHEMBL1096802
IUPHARN/A
BindingDB50316688
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
49645-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422

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