General Information of the Compound
| Compound ID |
CP0085943
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| Compound Name |
3-(2,4,6-Trimethoxybenzylidene)indolin-2-one
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| Synonyms |
IC 261
IC-261
IC261
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| Structure |
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| Formula |
C18H17NO4
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| Molecular Weight |
311.337
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| Canonical SMILES |
COc1cc(OC)c(\C=C2\C(=O)Nc3ccccc23)c(OC)c1
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| InChI |
InChI=1S/C18H17NO4/c1-21-11-8-16(22-2)14(17(9-11)23-3)10-13-12-6-4-5-7-15(12)19-18(13)20/h4-10H,1-3H3,(H,19,20)/b13-10+
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| InChIKey |
JBJYTZXCZDNOJW-JLHYYAGUSA-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
Clinical Information about the Compound