General Information of the Compound
| Compound ID |
CP0444117
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| Compound Name |
4-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyrimidin-2-amine
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| Structure |
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| Formula |
C18H24N4
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| Molecular Weight |
296.418
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| Canonical SMILES |
CC1CCN(CC1)c1ccnc(NCCc2ccccc2)n1
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| InChI |
InChI=1S/C18H24N4/c1-15-9-13-22(14-10-15)17-8-12-20-18(21-17)19-11-7-16-5-3-2-4-6-16/h2-6,8,12,15H,7,9-11,13-14H2,1H3,(H,19,20,21)
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| InChIKey |
FAHPWKWHSCNRBO-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