General Information of the Compound
| Compound ID |
CP0541559
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| Compound Name |
4-(4-morpholinyl)-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium
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| Structure |
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| Formula |
C10H10N4O5
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| Molecular Weight |
266.213
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| Canonical SMILES |
[O-][N+](=O)c1c[cH-]c(N2CCOCC2)c2[c+]1[n-]o[n+]2=O
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| InChI |
InChI=1S/C10H10N4O5/c15-13(16)7-1-2-8(12-3-5-18-6-4-12)10-9(7)11-19-14(10)17/h1-2H,3-6H2
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| InChIKey |
VJBMAFLDXIZVDK-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06172, Mothers against decapentaplegic homolog 3