General Information of the Compound
| Compound ID |
CP0502489
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| Compound Name |
3-chloro-N-[(E)-[4-(2,2-dimethylpropanoylamino)naphthalen-1-yl]methylideneamino]-4-hydroxybenzamide
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| Structure |
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| Formula |
C23H22ClN3O3
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| Molecular Weight |
423.9
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| Canonical SMILES |
CC(C)(C)C(=O)Nc1ccc(\C=N\NC(=O)c2ccc(O)c(Cl)c2)c2ccccc12
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| InChI |
InChI=1S/C23H22ClN3O3/c1-23(2,3)22(30)26-19-10-8-15(16-6-4-5-7-17(16)19)13-25-27-21(29)14-9-11-20(28)18(24)12-14/h4-13,28H,1-3H3,(H,26,30)(H,27,29)/b25-13+
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| InChIKey |
PTQLKQPZMIUUAS-DHRITJCHSA-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