General Information of the Compound
| Compound ID |
CP0387896
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| Compound Name |
4-N-(3,3-dimethylbutyl)-6-[3-(methylamino)azetidin-1-yl]pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C14H26N6
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| Molecular Weight |
278.404
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| Canonical SMILES |
CNC1CN(C1)c1cc(NCCC(C)(C)C)nc(N)n1
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| InChI |
InChI=1S/C14H26N6/c1-14(2,3)5-6-17-11-7-12(19-13(15)18-11)20-8-10(9-20)16-4/h7,10,16H,5-6,8-9H2,1-4H3,(H3,15,17,18,19)
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| InChIKey |
SUCIUIKQEGHDNX-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