General Information of the Compound
| Compound ID |
CP0436944
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| Compound Name |
4-Oxo-[(3-trifluoromethyl)phenyl]-2-thioxo-N-[4-(carboxy)phenyl]-5-thiazolidinethio carboxamide
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| Structure |
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| Formula |
C18H11F3N2O3S3
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| Molecular Weight |
456.492
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| Canonical SMILES |
OC(=O)c1ccc(NC(=S)C2SC(=S)N(C2=O)c2cccc(c2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C18H11F3N2O3S3/c19-18(20,21)10-2-1-3-12(8-10)23-15(24)13(29-17(23)28)14(27)22-11-6-4-9(5-7-11)16(25)26/h1-8,13H,(H,22,27)(H,25,26)
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| InChIKey |
GXIFTKGLTYOAQQ-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