General Information of the Compound
| Compound ID |
CP0443810
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| Compound Name |
6-(4-ethylpiperazin-1-yl)-9-(3-piperidin-1-ylpropyl)purine
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| Structure |
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| Formula |
C19H31N7
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| Molecular Weight |
357.506
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| Canonical SMILES |
CCN1CCN(CC1)c1ncnc2n(CCCN3CCCCC3)cnc12
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| InChI |
InChI=1S/C19H31N7/c1-2-23-11-13-25(14-12-23)18-17-19(21-15-20-18)26(16-22-17)10-6-9-24-7-4-3-5-8-24/h15-16H,2-14H2,1H3
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| InChIKey |
LDWGYNFWLYEGNU-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