General Information of the Compound
| Compound ID |
CP0502337
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| Compound Name |
3-(6-methoxypyridin-3-yl)-2-methylcyclopent-2-enone
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| Structure |
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| Formula |
C12H13NO2
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| Molecular Weight |
203.241
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| Canonical SMILES |
COc1ccc(cn1)C1=C(C)C(=O)CC1
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| InChI |
InChI=1S/C12H13NO2/c1-8-10(4-5-11(8)14)9-3-6-12(15-2)13-7-9/h3,6-7H,4-5H2,1-2H3
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| InChIKey |
LPVKUVZPZNDLSQ-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