General Information of the Compound
| Compound ID |
CP0470228
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| Compound Name |
1-(4-methoxybenzyl)-6-(trifluoromethoxy)indoline-2,3-dione
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| Structure |
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| Formula |
C17H12F3NO4
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| Molecular Weight |
351.28
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| Canonical SMILES |
COc1ccc(CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc23)cc1
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| InChI |
InChI=1S/C17H12F3NO4/c1-24-11-4-2-10(3-5-11)9-21-14-8-12(25-17(18,19)20)6-7-13(14)15(22)16(21)23/h2-8H,9H2,1H3
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| InChIKey |
RWTIUNAIYXQLTN-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