General Information of the Compound
| Compound ID |
CP0405390
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| Compound Name |
1-(3,4'-bipyridin-6-ylmethyl)-5-(trifluoromethoxy)indoline-2,3-dione
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| Structure |
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| Formula |
C20H12F3N3O3
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| Molecular Weight |
399.328
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| Canonical SMILES |
FC(F)(F)Oc1ccc2N(Cc3ccc(cn3)-c3ccncc3)C(=O)C(=O)c2c1
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| InChI |
InChI=1S/C20H12F3N3O3/c21-20(22,23)29-15-3-4-17-16(9-15)18(27)19(28)26(17)11-14-2-1-13(10-25-14)12-5-7-24-8-6-12/h1-10H,11H2
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| InChIKey |
PTNZNAUXIBHEHN-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