General Information of the Compound
| Compound ID |
CP0174355
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| Compound Name |
US8614253, 26-25
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| Structure |
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| Formula |
C11H10N2O3
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| Molecular Weight |
218.212
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| Canonical SMILES |
COc1cc(cc(C=O)c1O)-c1cn[nH]c1
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| InChI |
InChI=1S/C11H10N2O3/c1-16-10-3-7(9-4-12-13-5-9)2-8(6-14)11(10)15/h2-6,15H,1H3,(H,12,13)
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| InChIKey |
WDYNNQXPJNBKNE-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