General Information of the Compound
| Compound ID |
CP0110236
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| Compound Name |
4-tert-Butyl-3-methyl-2-(piperidine-1-carbonyl)-2H-isoxazol-5-one
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| Structure |
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| Formula |
C14H22N2O3
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| Molecular Weight |
266.341
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| Canonical SMILES |
Cc1c(c(=O)on1C(=O)N1CCCCC1)C(C)(C)C
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| InChI |
InChI=1S/C14H22N2O3/c1-10-11(14(2,3)4)12(17)19-16(10)13(18)15-8-6-5-7-9-15/h5-9H2,1-4H3
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| InChIKey |
PTCNHKVZXHGICF-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