General Information of the Compound
| Compound ID |
CP0439892
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| Compound Name |
2-[3-[[1-[(2,3-difluorophenyl)methyl]-6-oxopyridin-3-yl]methyl]-5-fluoro-2-methylindol-1-yl]-N,N-dimethylacetamide
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| Structure |
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| Formula |
C26H24F3N3O2
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| Molecular Weight |
467.491
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| Canonical SMILES |
CN(C)C(=O)Cn1c(C)c(Cc2ccc(=O)n(Cc3cccc(F)c3F)c2)c2cc(F)ccc12
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| InChI |
InChI=1S/C26H24F3N3O2/c1-16-20(21-12-19(27)8-9-23(21)32(16)15-25(34)30(2)3)11-17-7-10-24(33)31(13-17)14-18-5-4-6-22(28)26(18)29/h4-10,12-13H,11,14-15H2,1-3H3
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| InChIKey |
WCPMWRSWMDASJG-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