General Information of the Compound
| Compound ID |
CP0404805
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| Compound Name |
(E)-N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-3-(6-trifluoromethyl-pyridin-3-yl)-acrylamide
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| Structure |
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| Formula |
C17H13F3N2O3
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| Molecular Weight |
350.296
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| Canonical SMILES |
FC(F)(F)c1ccc(\C=C\C(=O)Nc2ccc3OCCOc3c2)cn1
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| InChI |
InChI=1S/C17H13F3N2O3/c18-17(19,20)15-5-1-11(10-21-15)2-6-16(23)22-12-3-4-13-14(9-12)25-8-7-24-13/h1-6,9-10H,7-8H2,(H,22,23)/b6-2+
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| InChIKey |
DXKGHALLKWGYEQ-QHHAFSJGSA-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