General Information of the Compound
| Compound ID |
CP0516016
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| Compound Name |
2-{4-[(3-Cyano-4-hydroxy-benzoyl)-hydrazonomethyl]-naphthalen-1-yl}-N,N-diethyl-acetamide
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| Structure |
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| Formula |
C25H24N4O3
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| Molecular Weight |
428.492
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| Canonical SMILES |
CCN(CC)C(=O)Cc1ccc(\C=N\NC(=O)c2ccc(O)c(c2)C#N)c2ccccc12
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| InChI |
InChI=1S/C25H24N4O3/c1-3-29(4-2)24(31)14-17-9-10-19(22-8-6-5-7-21(17)22)16-27-28-25(32)18-11-12-23(30)20(13-18)15-26/h5-13,16,30H,3-4,14H2,1-2H3,(H,28,32)/b27-16+
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| InChIKey |
DCHMKTYWVZBFDS-JVWAILMASA-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