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Ligand

Name3-chloro-6-(4-((2-methoxyethyl)sulfonyl)piperazin-1-yl)-2,2'-bipyridine
Molecular formulaC17H21ClN4O3S
IUPAC name1-(5-chloro-6-pyridin-2-ylpyridin-2-yl)-4-(2-methoxyethylsulfonyl)piperazine
Molecular weight396.89
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP1.5
Synonyms3-chloro-6-{4-[(2-methoxyethyl)sulfonyl]piperazin-1-yl}-2,2'-bipyridine
ADILYQIMCWQSFQ-UHFFFAOYSA-N
BDBM163009
CHEMBL3696794
SCHEMBL2712233
[ Show all ]
Inchi KeyADILYQIMCWQSFQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21ClN4O3S/c1-25-12-13-26(23,24)22-10-8-21(9-11-22)16-6-5-14(18)17(20-16)15-4-2-3-7-19-15/h2-7H,8-13H2,1H3
PubChem CID67508061
ChEMBLCHEMBL3696794
IUPHARN/A
BindingDB163009
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
459249Smoothened homologQ99835SMOHomo sapiens (Human)787

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