General Information of the Compound
| Compound ID |
CP0262823
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| Compound Name |
6-(3-methylbutyl)-2-(2-methylpropoxy)-N-(2-methylpropyl)pyrimidin-4-amine
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| Structure |
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| Formula |
C17H31N3O
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| Molecular Weight |
293.455
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| Canonical SMILES |
CC(C)CCc1cc(NCC(C)C)nc(OCC(C)C)n1
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| InChI |
InChI=1S/C17H31N3O/c1-12(2)7-8-15-9-16(18-10-13(3)4)20-17(19-15)21-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3,(H,18,19,20)
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| InChIKey |
NVVYPTVERJXDIN-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