General Information of the Compound
| Compound ID |
CP0894475
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| Compound Name |
6-(4-Methylpiperazin-1-yl)-N4-phenylpyrimidine-2,4-diamine
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| Structure |
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| Formula |
C15H20N6
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| Molecular Weight |
284.367
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| Canonical SMILES |
CN1CCN(c2cc(Nc3ccccc3)nc(N)n2)CC1
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| InChI |
InChI=1S/C15H20N6/c1-20-7-9-21(10-8-20)14-11-13(18-15(16)19-14)17-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H3,16,17,18,19)
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| InChIKey |
KLPLLDNFWGIAJW-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