General Information of the Compound
| Compound ID |
CP0479956
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| Compound Name |
5-[[4-[[4-(trifluoromethyl)phenyl]diazenyl]phenyl]methyl]-1,3-thiazolidine-2,4-dione
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| Formula |
C17H12F3N3O2S
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| Molecular Weight |
379.363
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)\N=N/c1ccc(CC2SC(=O)NC2=O)cc1
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| InChI |
InChI=1S/C17H12F3N3O2S/c18-17(19,20)11-3-7-13(8-4-11)23-22-12-5-1-10(2-6-12)9-14-15(24)21-16(25)26-14/h1-8,14H,9H2,(H,21,24,25)/b23-22-
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| InChIKey |
VFLGCPLWJDMTRY-FCQUAONHSA-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