General Information of the Compound
| Compound ID |
CP0379086
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| Compound Name |
3-Fluoro-5-(8-fluoro-4,4-dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-benzonitrile
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| Structure |
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| Formula |
C17H12F2N2O2
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| Molecular Weight |
314.291
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| Canonical SMILES |
CC1(C)OC(=O)Nc2c(F)cc(cc12)-c1cc(F)cc(c1)C#N
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| InChI |
InChI=1S/C17H12F2N2O2/c1-17(2)13-6-11(7-14(19)15(13)21-16(22)23-17)10-3-9(8-20)4-12(18)5-10/h3-7H,1-2H3,(H,21,22)
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| InChIKey |
PKVIKTBQZZTING-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