General Information of the Compound
| Compound ID |
CP0495378
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| Compound Name |
US9434711, 840
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| Structure |
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| Formula |
C17H15F3N2O2S2
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| Molecular Weight |
400.447
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| Canonical SMILES |
CCS(=O)(=O)N(Cc1c(F)cnc(F)c1F)c1sc2ccccc2c1C
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| InChI |
InChI=1S/C17H15F3N2O2S2/c1-3-26(23,24)22(9-12-13(18)8-21-16(20)15(12)19)17-10(2)11-6-4-5-7-14(11)25-17/h4-8H,3,9H2,1-2H3
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| InChIKey |
QZHSVENQODSGDU-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