General Information of the Compound
| Compound ID |
CP0346009
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| Compound Name |
6-(4-methylpiperazin-1-yl)-4-N-propan-2-ylpyrimidine-2,4-diamine
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| Structure |
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| Formula |
C12H22N6
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| Molecular Weight |
250.35
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| Canonical SMILES |
CC(C)Nc1cc(nc(N)n1)N1CCN(C)CC1
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| InChI |
InChI=1S/C12H22N6/c1-9(2)14-10-8-11(16-12(13)15-10)18-6-4-17(3)5-7-18/h8-9H,4-7H2,1-3H3,(H3,13,14,15,16)
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| InChIKey |
KAUYUPRYNGTHLK-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