General Information of the Compound
| Compound ID |
CP0492289
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| Compound Name |
3-Cyano-4-hydroxy-benzoic acid (4-hydroxymethyl-naphthalen-1-ylmethylene)-hydrazide
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| Structure |
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| Formula |
C20H15N3O3
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| Molecular Weight |
345.358
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| Canonical SMILES |
OCc1ccc(\C=N\NC(=O)c2ccc(O)c(c2)C#N)c2ccccc12
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| InChI |
InChI=1S/C20H15N3O3/c21-10-16-9-13(7-8-19(16)25)20(26)23-22-11-14-5-6-15(12-24)18-4-2-1-3-17(14)18/h1-9,11,24-25H,12H2,(H,23,26)/b22-11+
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| InChIKey |
BUYVLDHDDYAAED-SSDVNMTOSA-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