General Information of the Compound
| Compound ID |
CP0536976
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| Compound Name |
US8916553, 243
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| Structure |
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| Formula |
C16H15F3N2O2S
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| Molecular Weight |
356.369
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(-c2cnccc2C2CC2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C16H15F3N2O2S/c1-24(22,23)21-11-4-5-13(15(8-11)16(17,18)19)14-9-20-7-6-12(14)10-2-3-10/h4-10,21H,2-3H2,1H3
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| InChIKey |
VGPPLDQBDHQDMK-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