General Information of the Compound
| Compound ID |
CP0398278
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| Compound Name |
N-(2-bicyclo[2.2.1]heptanyl)-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine
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| Structure |
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| Formula |
C16H25N5
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| Molecular Weight |
287.411
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| Canonical SMILES |
CN1CCN(CC1)c1ccnc(NC2CC3CCC2C3)n1
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| InChI |
InChI=1S/C16H25N5/c1-20-6-8-21(9-7-20)15-4-5-17-16(19-15)18-14-11-12-2-3-13(14)10-12/h4-5,12-14H,2-3,6-11H2,1H3,(H,17,18,19)
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| InChIKey |
IVFQODBYXHLMLR-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