General Information of the Compound
| Compound ID |
CP0575920
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| Compound Name |
7-fluoro-4-hydroxy-12-methyl-N-[(4-methylpyridin-3-yl)methyl]-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-3,5,7,9(13)-tetraene-3-carboxamide
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| Structure |
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| Formula |
C21H20FN3O3
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| Molecular Weight |
381.407
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| Canonical SMILES |
CC1CCc2cc(F)cc3c(O)c(C(=O)NCc4cnccc4C)c(=O)n1c23
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| InChI |
InChI=1S/C21H20FN3O3/c1-11-5-6-23-9-14(11)10-24-20(27)17-19(26)16-8-15(22)7-13-4-3-12(2)25(18(13)16)21(17)28/h5-9,12,26H,3-4,10H2,1-2H3,(H,24,27)
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| InChIKey |
PNKFIZDBDDKBQI-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