General Information of the Compound
| Compound ID |
CP0498566
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| Compound Name |
2-Hydroxy-5-[1-(4-hydroxy-3,5-diisopropyl-phenyl)-meth-(Z)-ylidene]-thiazol-4-one
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| Structure |
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| Formula |
C16H19NO3S
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| Molecular Weight |
305.399
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| Canonical SMILES |
CC(C)c1cc(\C=C2/SC(=O)NC2=O)cc(C(C)C)c1O
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| InChI |
InChI=1S/C16H19NO3S/c1-8(2)11-5-10(6-12(9(3)4)14(11)18)7-13-15(19)17-16(20)21-13/h5-9,18H,1-4H3,(H,17,19,20)/b13-7-
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| InChIKey |
PJHWHESCEXNAHD-QPEQYQDCSA-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