General Information of the Compound
| Compound ID |
CP0930689
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| Compound Name |
5-[1-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-eth-(Z)-ylidene]-4-oxo-4,5-dihydro-thiazol-2-yl-cyanamide
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| Structure |
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| Formula |
C20H25N3O2S
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| Molecular Weight |
371.506
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| Canonical SMILES |
C/C(=C1/SC(NC#N)=NC1=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
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| InChI |
InChI=1S/C20H25N3O2S/c1-11(16-17(25)23-18(26-16)22-10-21)12-8-13(19(2,3)4)15(24)14(9-12)20(5,6)7/h8-9,24H,1-7H3,(H,22,23,25)/b16-11-
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| InChIKey |
LKBAFEZJUPGYBI-WJDWOHSUSA-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