General Information of the Compound
| Compound ID |
CP0730795
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| Compound Name |
4-(2,4-Difluoro-6-methoxybenzyl)-2-(3,4-dimethoxyphenyl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide
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| Structure |
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| Formula |
C23H20F2N2O6S
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| Molecular Weight |
490.484
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| Canonical SMILES |
COc1ccc(N2C(=O)N(Cc3c(F)cc(F)cc3OC)c3ccccc3S2(=O)=O)cc1OC
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| InChI |
InChI=1S/C23H20F2N2O6S/c1-31-19-9-8-15(12-21(19)33-3)27-23(28)26(18-6-4-5-7-22(18)34(27,29)30)13-16-17(25)10-14(24)11-20(16)32-2/h4-12H,13H2,1-3H3
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| InChIKey |
LPPIIVYMLMVMQT-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