General Information of the Compound
| Compound ID |
CP0638209
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| Compound Name |
5-(2,2-difluoro-6-methylbenzo[d][1,3]dioxol-5-yl)-N-(2-methylbenzyl)pyridin-2-amine
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| Structure |
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| Formula |
C21H18F2N2O2
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| Molecular Weight |
368.383
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| Canonical SMILES |
Cc1ccccc1CNc1ccc(-c2cc3c(cc2C)OC(F)(F)O3)cn1
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| InChI |
InChI=1S/C21H18F2N2O2/c1-13-5-3-4-6-15(13)11-24-20-8-7-16(12-25-20)17-10-19-18(9-14(17)2)26-21(22,23)27-19/h3-10,12H,11H2,1-2H3,(H,24,25)
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| InChIKey |
MBPRBMDDBLSBKX-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