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Ligand

NameCHEMBL60318
Molecular formulaC20H22FN3OS
IUPAC name6-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]-3-methyl-1,3-benzothiazol-2-one
Molecular weight371.474
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.9
SynonymsBDBM50064579
6-{2-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-ethyl}-3-methyl-3H-benzothiazol-2-one
Inchi KeyCGHICUOGCBNVLX-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22FN3OS/c1-22-18-7-2-15(14-19(18)26-20(22)25)8-9-23-10-12-24(13-11-23)17-5-3-16(21)4-6-17/h2-7,14H,8-13H2,1H3
PubChem CID10809238
ChEMBLCHEMBL60318
IUPHARN/A
BindingDB50064579
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: 5
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GLASS IDNameUniProtGeneSpeciesLength
413135-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
413125-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
413145-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
41315Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
41311D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444

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