General Information of the Compound
| Compound ID |
CP0103630
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| Compound Name |
3-(4-hydroxy-3,5-diisopropylbenzylidene)indolin-2-one
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| Structure |
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| Formula |
C21H23NO2
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| Molecular Weight |
321.42
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| Canonical SMILES |
CC(C)c1cc(\C=C2/C(=O)Nc3ccccc23)cc(C(C)C)c1O
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| InChI |
InChI=1S/C21H23NO2/c1-12(2)16-9-14(10-17(13(3)4)20(16)23)11-18-15-7-5-6-8-19(15)22-21(18)24/h5-13,23H,1-4H3,(H,22,24)/b18-11-
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| InChIKey |
UGWOQEABVJFWIV-WQRHYEAKSA-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