General Information of the Compound
| Compound ID |
CP0567901
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| Compound Name |
US9434711, 217
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| Structure |
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| Formula |
C19H17F4NO3S2
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| Molecular Weight |
447.475
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| Canonical SMILES |
CCS(=O)(=O)N(Cc1ccc(F)c(c1)C(F)(F)F)c1sc2ccccc2c1CO
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| InChI |
InChI=1S/C19H17F4NO3S2/c1-2-29(26,27)24(10-12-7-8-16(20)15(9-12)19(21,22)23)18-14(11-25)13-5-3-4-6-17(13)28-18/h3-9,25H,2,10-11H2,1H3
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| InChIKey |
TUVDEBLUMCPVRT-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