General Information of the Compound
| Compound ID |
CP0572059
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| Compound Name |
4-[(1-methylcyclopropyl)amino]-2-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]-6-propan-2-ylpyrido[4,3-d]pyrimidin-5-one
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| Structure |
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| Formula |
C23H32N8O
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| Molecular Weight |
436.564
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| Canonical SMILES |
CC(C)n1ccc2nc(Nc3cnn(c3)C3CCN(C)CC3)nc(NC3(C)CC3)c2c1=O
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| InChI |
InChI=1S/C23H32N8O/c1-15(2)30-12-7-18-19(21(30)32)20(28-23(3)8-9-23)27-22(26-18)25-16-13-24-31(14-16)17-5-10-29(4)11-6-17/h7,12-15,17H,5-6,8-11H2,1-4H3,(H2,25,26,27,28)
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| InChIKey |
CTWXYOQORJJPQH-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