General Information of the Compound
| Compound ID |
CP0091990
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| Compound Name |
2-N-methyl-6-(3-methylbutyl)-2-N,4-N-bis(2-methylpropyl)pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C18H34N4
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| Molecular Weight |
306.498
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| Canonical SMILES |
CC(C)CCc1cc(NCC(C)C)nc(n1)N(C)CC(C)C
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| InChI |
InChI=1S/C18H34N4/c1-13(2)8-9-16-10-17(19-11-14(3)4)21-18(20-16)22(7)12-15(5)6/h10,13-15H,8-9,11-12H2,1-7H3,(H,19,20,21)
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| InChIKey |
NSKAIYJKIKEZIG-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