General Information of the Compound
| Compound ID |
CP0572310
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| Compound Name |
US9434711, 346
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| Structure |
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| Formula |
C21H22F4N2O2S2
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| Molecular Weight |
474.545
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| Canonical SMILES |
CCS(=O)(=O)N(Cc1ccc(F)c(c1)C(F)(F)F)c1sc2ccccc2c1CN(C)C
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| InChI |
InChI=1S/C21H22F4N2O2S2/c1-4-31(28,29)27(12-14-9-10-18(22)17(11-14)21(23,24)25)20-16(13-26(2)3)15-7-5-6-8-19(15)30-20/h5-11H,4,12-13H2,1-3H3
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| InChIKey |
BVGUHKOKVAMDFW-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