General Information of the Compound
| Compound ID |
CP0549654
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| Compound Name |
N-methyl-4-(2,2,2-trifluoroethoxy)-3-[(5,6,7-trimethoxyquinazolin-4-yl)amino]benzenesulfonamide
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| Structure |
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| Formula |
C20H21F3N4O6S
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| Molecular Weight |
502.471
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| Canonical SMILES |
CNS(=O)(=O)c1ccc(OCC(F)(F)F)c(Nc2ncnc3cc(OC)c(OC)c(OC)c23)c1
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| InChI |
InChI=1S/C20H21F3N4O6S/c1-24-34(28,29)11-5-6-14(33-9-20(21,22)23)12(7-11)27-19-16-13(25-10-26-19)8-15(30-2)17(31-3)18(16)32-4/h5-8,10,24H,9H2,1-4H3,(H,25,26,27)
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| InChIKey |
POLFXEZBQNZFED-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