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Ligand

NameCHEMBL142456
Molecular formulaC24H27N5OS
IUPAC nameN-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1H-indole-3-carboxamide
Molecular weight433.574
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50054708
1H-Indole-3-carboxylic acid [4-(4-benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-amide
N-[4-[4-(1,2-Benzisothiazol-3-yl)piperazino]butyl]-1H-indole-3-carboxamide
Inchi KeyNTTCFOLAAJRIDE-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H27N5OS/c30-24(20-17-26-21-9-3-1-7-18(20)21)25-11-5-6-12-28-13-15-29(16-14-28)23-19-8-2-4-10-22(19)31-27-23/h1-4,7-10,17,26H,5-6,11-16H2,(H,25,30)
PubChem CID10717656
ChEMBLCHEMBL142456
IUPHARN/A
BindingDB50054708
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
2319185-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
231917D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444

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