General Information of the Compound
| Compound ID |
CP0851271
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| Compound Name |
4-(4-Methylpiperazin-1-yl)-6-phenylsulfanylpyrimidin-2-ylamine
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| Structure |
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| Formula |
C15H19N5S
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| Molecular Weight |
301.419
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| Canonical SMILES |
CN1CCN(c2cc(Sc3ccccc3)nc(N)n2)CC1
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| InChI |
InChI=1S/C15H19N5S/c1-19-7-9-20(10-8-19)13-11-14(18-15(16)17-13)21-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H2,16,17,18)
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| InChIKey |
YVNKBLKIGVQRLB-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