General Information of the Compound
| Compound ID |
CP0090849
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| Compound Name |
3-(5-((5-tert-butyloxazol-2-yl)methylthio)thiazol-2-ylamino)cyclohexanol
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| Structure |
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| Formula |
C17H25N3O2S2
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| Molecular Weight |
367.54
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| Canonical SMILES |
CC(C)(C)c1cnc(CSc2cnc(NC3CCCC(O)C3)s2)o1
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| InChI |
InChI=1S/C17H25N3O2S2/c1-17(2,3)13-8-18-14(22-13)10-23-15-9-19-16(24-15)20-11-5-4-6-12(21)7-11/h8-9,11-12,21H,4-7,10H2,1-3H3,(H,19,20)
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| InChIKey |
WOQQURWNFMADML-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