General Information of the Compound
| Compound ID |
CP0101456
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| Compound Name |
5-(2-(3-(trifluoromethyl)phenylamino)phenyl)-1,3,4-thiadiazole-2(3H)-thione
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| Structure |
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| Formula |
C15H10F3N3S2
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| Molecular Weight |
353.394
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| Canonical SMILES |
FC(F)(F)c1cccc(Nc2ccccc2-c2nnc(S)s2)c1
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| InChI |
InChI=1S/C15H10F3N3S2/c16-15(17,18)9-4-3-5-10(8-9)19-12-7-2-1-6-11(12)13-20-21-14(22)23-13/h1-8,19H,(H,21,22)
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| InChIKey |
SSRDENPJPAFZCP-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