General Information of the Compound
| Compound ID |
CP0495371
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| Compound Name |
US9434711, 776
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| Structure |
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| Formula |
C21H24FNO4S2
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| Molecular Weight |
437.558
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| Canonical SMILES |
CCS(=O)(=O)N(Cc1cccc(OC)c1F)c1sc2ccccc2c1C(C)(C)O
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| InChI |
InChI=1S/C21H24FNO4S2/c1-5-29(25,26)23(13-14-9-8-11-16(27-4)19(14)22)20-18(21(2,3)24)15-10-6-7-12-17(15)28-20/h6-12,24H,5,13H2,1-4H3
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| InChIKey |
YWUWEOABEPYROC-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