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Ligand

NameCHEMBL209985
Molecular formulaC19H32N4O3S
IUPAC nameN-[3-[4-[4-(propan-2-ylsulfonylamino)butyl]piperazin-1-yl]phenyl]acetamide
Molecular weight396.55
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.7
SynonymsSCHEMBL1385801
BDBM50187388
N-(3-{4-[4-(propane-2-sulfonylamino)-butyl]-piperazin-1-yl}-phenyl)-acetamide
Inchi KeyCPBIWHVJLGAGPZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H32N4O3S/c1-16(2)27(25,26)20-9-4-5-10-22-11-13-23(14-12-22)19-8-6-7-18(15-19)21-17(3)24/h6-8,15-16,20H,4-5,9-14H2,1-3H3,(H,21,24)
PubChem CID10318597
ChEMBLCHEMBL209985
IUPHARN/A
BindingDB50187388
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
472075-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
47206Alpha-2A adrenergic receptorP22909Adra2aRattus norvegicus (Rat)450

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