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Ligand

NameCHEMBL280314
Molecular formulaC25H31FN4O3
IUPAC nameN-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-(5-fluoro-1H-indol-3-yl)piperidine-1-carboxamide
Molecular weight454.546
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.6
SynonymsBDBM50086113
N-[3-[2-(Dimethylamino)ethoxy]-4-methoxyphenyl]-4-(5-fluoro-1H-indole-3-yl)piperidine-1-carboxamide
4-(5-Fluoro-1H-indol-3-yl)-piperidine-1-carboxylic acid [3-(2-dimethylamino-ethoxy)-4-methoxy-phenyl]-amide
Inchi KeyGHQNRRDUAUSWGE-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H31FN4O3/c1-29(2)12-13-33-24-15-19(5-7-23(24)32-3)28-25(31)30-10-8-17(9-11-30)21-16-27-22-6-4-18(26)14-20(21)22/h4-7,14-17,27H,8-13H2,1-3H3,(H,28,31)
PubChem CID10551680
ChEMBLCHEMBL280314
IUPHARN/A
BindingDB50086113
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
967155-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
967145-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
967135-hydroxytryptamine receptor 1DP28565Htr1dRattus norvegicus (Rat)374

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