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Ligand

NameCHEMBL3966784
Molecular formulaC17H21Cl2N3O2S
IUPAC name1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-4-[(4-chlorophenyl)methyl]piperidine
Molecular weight402.334
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.1
Synonyms1-((5-Chloro-1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-4-(4 chlorobenzyl)piperidine
US9475795, 68
BDBM250589
1-((5-Chloro-1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-4-(4chlorobenzyl)piperidine
BOTHEIGTHCWZNG-UHFFFAOYSA-N
[ Show all ]
Inchi KeyBOTHEIGTHCWZNG-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21Cl2N3O2S/c1-12-16(17(19)21(2)20-12)25(23,24)22-9-7-14(8-10-22)11-13-3-5-15(18)6-4-13/h3-6,14H,7-11H2,1-2H3
PubChem CID72550668
ChEMBLCHEMBL3966784
IUPHARN/A
BindingDB250589
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
534018Prokineticin receptor 1Q8TCW9PROKR1Homo sapiens (Human)393

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