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Ligand

NameCHEMBL141392
Molecular formulaC21H26N6OS
IUPAC name2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]pyridine-3-carboxamide
Molecular weight410.54
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.4
Synonyms2-Amino-N-[4-(4-benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-nicotinamide
BDBM50054705
N-[4-[4-(1,2-Benzisothiazol-3-yl)piperazino]butyl]-2-aminopyridine-3-carboxamide
SCHEMBL9270969
Inchi KeyVXSBWAZGDNTUOU-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H26N6OS/c22-19-17(7-5-10-23-19)21(28)24-9-3-4-11-26-12-14-27(15-13-26)20-16-6-1-2-8-18(16)29-25-20/h1-2,5-8,10H,3-4,9,11-15H2,(H2,22,23)(H,24,28)
PubChem CID10716504
ChEMBLCHEMBL141392
IUPHARN/A
BindingDB50054705
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
3668045-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
366803D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444

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