General Information of the Compound
| Compound ID |
CP0564448
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| Compound Name |
US9434711, 707
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| Structure |
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| Formula |
C20H16BrF4NO4S2
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| Molecular Weight |
554.381
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| Canonical SMILES |
OC(=O)c1ccc(c(F)c1)S(=O)(=O)N(CCCCC(F)(F)F)c1sc2ccccc2c1Br
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| InChI |
InChI=1S/C20H16BrF4NO4S2/c21-17-13-5-1-2-6-15(13)31-18(17)26(10-4-3-9-20(23,24)25)32(29,30)16-8-7-12(19(27)28)11-14(16)22/h1-2,5-8,11H,3-4,9-10H2,(H,27,28)
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| InChIKey |
XVPBDNNMNWCYCK-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