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Ligand

NameMLS000083032
Molecular formulaC16H12Cl2N6S
IUPAC name6-(3,4-dichlorophenyl)-3-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Molecular weight391.274
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.9
SynonymsBDBM42473
MLS002583900
6-(3,4-dichlorophenyl)-3-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
CHEMBL1527817
REGID_for_CID_665910
[ Show all ]
Inchi KeyAKVGDCSDHQWUBP-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H12Cl2N6S/c17-10-5-4-8(6-11(10)18)13-7-25-16-22-21-15(24(16)23-13)14-9-2-1-3-12(9)19-20-14/h4-6H,1-3,7H2,(H,19,20)
PubChem CID665910
ChEMBLCHEMBL1527817
IUPHARN/A
BindingDB42473
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7933Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
7932Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381
7931Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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