General Information of the Compound
| Compound ID |
CP0329045
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| Compound Name |
4-(4-methoxybenzoyloxyimino)-2,6-dimethylcyclohexa-2,5-dienone
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| Structure |
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| Formula |
C16H15NO4
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| Molecular Weight |
285.299
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| Canonical SMILES |
COc1ccc(cc1)C(=O)ON=C1C=C(C)C(=O)C(C)=C1
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| InChI |
InChI=1S/C16H15NO4/c1-10-8-13(9-11(2)15(10)18)17-21-16(19)12-4-6-14(20-3)7-5-12/h4-9H,1-3H3
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| InChIKey |
XPJOSLKXXOAVEN-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
Protein ID: PT06109, Geminin
Protein ID: PT04678, Serine hydrolase RBBP9