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Ligand

NameCHEMBL210874
Molecular formulaC24H31FN4O3S
IUPAC nameN-[3-[4-[[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]methyl]piperazin-1-yl]phenyl]acetamide
Molecular weight474.595
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.7
SynonymsSCHEMBL1382129
BDBM50187376
N-(3-(4-((1-(4-fluorophenylsulfonyl)piperidin-4-yl)methyl)piperazin-1-yl)phenyl)acetamide
Inchi KeyMMOSXZZEPZECBR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31FN4O3S/c1-19(30)26-22-3-2-4-23(17-22)28-15-13-27(14-16-28)18-20-9-11-29(12-10-20)33(31,32)24-7-5-21(25)6-8-24/h2-8,17,20H,9-16,18H2,1H3,(H,26,30)
PubChem CID10005122
ChEMBLCHEMBL210874
IUPHARN/A
BindingDB50187376
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
2091795-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
209178Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450

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