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Ligand

NameCHEMBL1834347
Molecular formulaC16H21ClN4O2S
IUPAC nameN-(3-chlorophenyl)sulfonyl-N'-ethyl-2,3-diazaspiro[4.4]non-3-ene-2-carboximidamide
Molecular weight368.88
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.7
SynonymsBDBM50354611
SCHEMBL12872149
Inchi KeyAJIIMRANVHWEGL-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H21ClN4O2S/c1-2-18-15(21-12-16(11-19-21)8-3-4-9-16)20-24(22,23)14-7-5-6-13(17)10-14/h5-7,10-11H,2-4,8-9,12H2,1H3,(H,18,20)
PubChem CID56593931
ChEMBLCHEMBL1834347
IUPHARN/A
BindingDB50354611
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
69445-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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