General Information of the Compound
| Compound ID |
CP0494194
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| Compound Name |
N-cyclohexyl-N-hydroxy-3-(11-oxo-6H-benzo[c][1]benzoxepin-2-yl)propanamide
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| Structure |
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| Formula |
C23H25NO4
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| Molecular Weight |
379.456
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| Canonical SMILES |
ON(C1CCCCC1)C(=O)CCc1ccc2OCc3ccccc3C(=O)c2c1
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| InChI |
InChI=1S/C23H25NO4/c25-22(24(27)18-7-2-1-3-8-18)13-11-16-10-12-21-20(14-16)23(26)19-9-5-4-6-17(19)15-28-21/h4-6,9-10,12,14,18,27H,1-3,7-8,11,13,15H2
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| InChIKey |
JVDHPCPMVPAFOW-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