General Information of the Compound
| Compound ID |
CP0239697
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| Compound Name |
2-(tert-butyldisulfanyl)-1H-benzimidazole
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| Structure |
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| Formula |
C11H14N2S2
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| Molecular Weight |
238.381
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| Canonical SMILES |
CC(C)(C)SSc1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C11H14N2S2/c1-11(2,3)15-14-10-12-8-6-4-5-7-9(8)13-10/h4-7H,1-3H3,(H,12,13)
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| InChIKey |
JUGXHSUVCKNTAC-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