General Information of the Compound
| Compound ID |
CP0574958
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| Compound Name |
6-(4-amino-4-methylpiperidin-1-yl)-3-(2,3-dichlorophenyl)-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one
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| Structure |
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| Formula |
C17H18Cl2N6O
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| Molecular Weight |
393.278
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| Canonical SMILES |
CC1(N)CCN(CC1)c1nc2[nH]nc(-c3cccc(Cl)c3Cl)c2c(=O)[nH]1
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| InChI |
InChI=1S/C17H18Cl2N6O/c1-17(20)5-7-25(8-6-17)16-21-14-11(15(26)22-16)13(23-24-14)9-3-2-4-10(18)12(9)19/h2-4H,5-8,20H2,1H3,(H2,21,22,23,24,26)
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| InChIKey |
IQTJXOXWFRJRQG-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