General Information of the Compound
| Compound ID |
CP0388594
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| Compound Name |
1-((6-phenylpyridin-3-yl)methyl)-5-(trifluoromethoxy)indoline-2,3-dione
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| Structure |
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| Formula |
C21H13F3N2O3
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| Molecular Weight |
398.34
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| Canonical SMILES |
FC(F)(F)Oc1ccc2N(Cc3ccc(nc3)-c3ccccc3)C(=O)C(=O)c2c1
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| InChI |
InChI=1S/C21H13F3N2O3/c22-21(23,24)29-15-7-9-18-16(10-15)19(27)20(28)26(18)12-13-6-8-17(25-11-13)14-4-2-1-3-5-14/h1-11H,12H2
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| InChIKey |
QULRUOVLZAHRKQ-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