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Ligand

NameCHEMBL210537
Molecular formulaC23H32N4O3S
IUPAC nameN-[3-[4-[4-[(4-methylphenyl)sulfonylamino]butyl]piperazin-1-yl]phenyl]acetamide
Molecular weight444.594
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.8
SynonymsSCHEMBL3869342
BDBM50187387
N-(3-(4-(4-(4-methylphenylsulfonamido)butyl)piperazin-1-yl)phenyl)acetamide
N-(3-{4-[4-(toluene-4-sulfonylamino)-butyl]-piperazin-1-yl}-phenyl)-acetamide
Inchi KeyGDSVOHILVQPEJQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H32N4O3S/c1-19-8-10-23(11-9-19)31(29,30)24-12-3-4-13-26-14-16-27(17-15-26)22-7-5-6-21(18-22)25-20(2)28/h5-11,18,24H,3-4,12-17H2,1-2H3,(H,25,28)
PubChem CID10343434
ChEMBLCHEMBL210537
IUPHARN/A
BindingDB50187387
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
939535-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
93954Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450

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