General Information of the Compound
| Compound ID |
CP0538537
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| Compound Name |
1-[2-fluoro-6-(trifluoromethyl)phenyl]-3-[(E)-2-(1,3-thiazol-2-yl)ethenyl]sulfonylurea
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| Structure |
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| Formula |
C13H9F4N3O3S2
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| Molecular Weight |
395.359
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| Canonical SMILES |
Fc1cccc(c1NC(=O)NS(=O)(=O)\C=C\c1nccs1)C(F)(F)F
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| InChI |
InChI=1S/C13H9F4N3O3S2/c14-9-3-1-2-8(13(15,16)17)11(9)19-12(21)20-25(22,23)7-4-10-18-5-6-24-10/h1-7H,(H2,19,20,21)/b7-4+
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| InChIKey |
DZUNDNOCQSYKFR-QPJJXVBHSA-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