General Information of the Compound
| Compound ID |
CP0236739
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| Compound Name |
5-ethyl-4-methyl-N-(3-oxidanylpyridin-2-yl)thiophene-2-carboxamide
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| Structure |
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| Formula |
C13H14N2O2S
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| Molecular Weight |
262.334
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| Canonical SMILES |
CCc1sc(cc1C)C(=O)Nc1ncccc1O
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| InChI |
InChI=1S/C13H14N2O2S/c1-3-10-8(2)7-11(18-10)13(17)15-12-9(16)5-4-6-14-12/h4-7,16H,3H2,1-2H3,(H,14,15,17)
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| InChIKey |
BYZMKNREIRLNCQ-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: PT06101, Latent membrane protein 1