General Information of the Compound
| Compound ID |
CP0492322
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| Compound Name |
2-(4-Chloro-phenyl)-N-{4-[(3-cyano-4-hydroxy-benzoyl)-hydrazonomethyl]-3-methoxy-phenyl}-acetamide
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| Structure |
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| Formula |
C24H19ClN4O4
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| Molecular Weight |
462.893
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| Canonical SMILES |
COc1cc(NC(=O)Cc2ccc(Cl)cc2)ccc1\C=N\NC(=O)c1ccc(O)c(c1)C#N
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| InChI |
InChI=1S/C24H19ClN4O4/c1-33-22-12-20(28-23(31)10-15-2-6-19(25)7-3-15)8-4-17(22)14-27-29-24(32)16-5-9-21(30)18(11-16)13-26/h2-9,11-12,14,30H,10H2,1H3,(H,28,31)(H,29,32)/b27-14+
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| InChIKey |
JDWHJNQGGZXHOV-MZJWZYIUSA-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