General Information of the Compound
| Compound ID |
CP0489316
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| Compound Name |
9-(2-(benzylamino)ethyl)-1,3-dimethyl-6,7,8,9-tetrahydropyrimido[1,2-a]purine-2,4(1H,3H)-dione
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| Structure |
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| Formula |
C19H24N6O2
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| Molecular Weight |
368.441
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| Canonical SMILES |
Cn1c2nc3N(CCNCc4ccccc4)CCCn3c2c(=O)n(C)c1=O
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| InChI |
InChI=1S/C19H24N6O2/c1-22-16-15(17(26)23(2)19(22)27)25-11-6-10-24(18(25)21-16)12-9-20-13-14-7-4-3-5-8-14/h3-5,7-8,20H,6,9-13H2,1-2H3
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| InChIKey |
NMGAXSONNKMDIR-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