General Information of the Compound
| Compound ID |
CP0880855
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| Compound Name |
4-(4-Methylpiperazin-1-yl)-6-(1H-pyrazol-4-yl)pyrimidin-2-ylamine
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| Structure |
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| Formula |
C12H17N7
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| Molecular Weight |
259.317
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| Canonical SMILES |
CN1CCN(c2cc(-c3cn[nH]c3)nc(N)n2)CC1
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| InChI |
InChI=1S/C12H17N7/c1-18-2-4-19(5-3-18)11-6-10(16-12(13)17-11)9-7-14-15-8-9/h6-8H,2-5H2,1H3,(H,14,15)(H2,13,16,17)
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| InChIKey |
VFVAYAJYQHUFEX-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