General Information of the Compound
| Compound ID |
CP0577196
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| Compound Name |
3-[2,4-diacetyl-5-[3-(2,3-dimethylanilino)-2,3-dioxopropyl]phenyl]-N-(2,3-dimethylphenyl)-2-oxopropanamide
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| Formula |
C32H32N2O6
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| Molecular Weight |
540.616
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| Canonical SMILES |
CC(=O)c1cc(C(C)=O)c(CC(=O)C(=O)Nc2cccc(C)c2C)cc1CC(=O)C(=O)Nc1cccc(C)c1C
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| InChI |
InChI=1S/C32H32N2O6/c1-17-9-7-11-27(19(17)3)33-31(39)29(37)14-23-13-24(26(22(6)36)16-25(23)21(5)35)15-30(38)32(40)34-28-12-8-10-18(2)20(28)4/h7-13,16H,14-15H2,1-6H3,(H,33,39)(H,34,40)
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| InChIKey |
VIINTXKLQRVRAV-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