General Information of the Compound
| Compound ID |
CP0408225
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| Compound Name |
5-(1-tert-butyl-4,5,6,7-tetrahydrobenzotriazol-5-yl)-3-cyclohexyl-1,2,4-oxadiazole
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| Structure |
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| Formula |
C18H27N5O
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| Molecular Weight |
329.448
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| Canonical SMILES |
CC(C)(C)n1nnc2CC(CCc12)c1nc(no1)C1CCCCC1
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| InChI |
InChI=1S/C18H27N5O/c1-18(2,3)23-15-10-9-13(11-14(15)20-22-23)17-19-16(21-24-17)12-7-5-4-6-8-12/h12-13H,4-11H2,1-3H3
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| InChIKey |
WWNTZZFTQLZTTN-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