General Information of the Compound
| Compound ID |
CP0464061
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| Compound Name |
8-cyclopentyl-2-cyclopentyloxy-1-propyl-7H-purin-6-one
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| Structure |
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| Formula |
C18H26N4O2
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| Molecular Weight |
330.432
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| Canonical SMILES |
CCCn1c(OC2CCCC2)nc2nc([nH]c2c1=O)C1CCCC1
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| InChI |
InChI=1S/C18H26N4O2/c1-2-11-22-17(23)14-16(20-15(19-14)12-7-3-4-8-12)21-18(22)24-13-9-5-6-10-13/h12-13H,2-11H2,1H3,(H,19,20)
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| InChIKey |
SVIXZCUMQSKZPM-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