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Ligand

NameClothiapine
Molecular formulaC18H18ClN3S
IUPAC name8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzothiazepine
Molecular weight343.873
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.6
SynonymsJ-013441
NCGC00160387-04
Tox21_111779_1
2-Chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f][1,4]thiazepine
AB01275460-01
[ Show all ]
Inchi KeyKAAZGXDPUNNEFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18ClN3S/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
PubChem CID16351
ChEMBLCHEMBL304902
IUPHARN/A
BindingDB50040237
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5561255-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1641735-hydroxytryptamine receptor 6P31388Htr6Rattus norvegicus (Rat)436
5561245-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
164174D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
164172D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
460687D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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