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Ligand

NameCHEMBL129708
Molecular formulaC19H18N2O4S
IUPAC name1'-(3-nitrophenyl)sulfonylspiro[indene-1,4'-piperidine]
Molecular weight370.423
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.7
Synonyms1-[(3-Nitrophenyl)sulfonyl]spiro[piperidine-4,1'-[1H]indene]
1''-(3-nitrophenylsulfonyl)spiro[1H-indene-1,4''-(hexahydropyridine)]
BDBM50001384
Inchi KeyDMQHJHDPONHWRM-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H18N2O4S/c22-21(23)16-5-3-6-17(14-16)26(24,25)20-12-10-19(11-13-20)9-8-15-4-1-2-7-18(15)19/h1-9,14H,10-13H2
PubChem CID10317073
ChEMBLCHEMBL129708
IUPHARN/A
BindingDB50001384
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
63938Oxytocin receptorP70536OxtrRattus norvegicus (Rat)388

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