General Information of the Compound
| Compound ID |
CP0372171
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| Compound Name |
3-[3-(4-Cyano-2-methyl-3-trifluoromethylphenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl]propane-1-sulfonamide
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| Structure |
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| Formula |
C17H19F3N4O3S2
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| Molecular Weight |
448.492
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| Canonical SMILES |
Cc1c(ccc(C#N)c1C(F)(F)F)N1C(=S)N(CCCS(N)(=O)=O)C(C)(C)C1=O
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| InChI |
InChI=1S/C17H19F3N4O3S2/c1-10-12(6-5-11(9-21)13(10)17(18,19)20)24-14(25)16(2,3)23(15(24)28)7-4-8-29(22,26)27/h5-6H,4,7-8H2,1-3H3,(H2,22,26,27)
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| InChIKey |
LZPRUZAMSHSECE-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