General Information of the Compound
| Compound ID |
CP0639320
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| Compound Name |
5-(2,5-bis(trifluoromethyl)phenoxy)-N-(2,4,6-trifluorobenzyl)pyridin-2-amine
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| Structure |
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| Formula |
C20H11F9N2O
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| Molecular Weight |
466.303
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| Canonical SMILES |
Fc1cc(F)c(CNc2ccc(Oc3cc(C(F)(F)F)ccc3C(F)(F)F)cn2)c(F)c1
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| InChI |
InChI=1S/C20H11F9N2O/c21-11-6-15(22)13(16(23)7-11)9-31-18-4-2-12(8-30-18)32-17-5-10(19(24,25)26)1-3-14(17)20(27,28)29/h1-8H,9H2,(H,30,31)
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| InChIKey |
DPSCVABMFPBXTR-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