General Information of the Compound
| Compound ID |
CP0012651
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| Compound Name |
(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(pyrrolidin-1-ylmethyl)oxolane-3,4-diol
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| Structure |
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| Formula |
C14H20N6O3
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| Molecular Weight |
320.353
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| Canonical SMILES |
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CN2CCCC2)[C@@H](O)[C@H]1O
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| InChI |
InChI=1S/C14H20N6O3/c15-12-9-13(17-6-16-12)20(7-18-9)14-11(22)10(21)8(23-14)5-19-3-1-2-4-19/h6-8,10-11,14,21-22H,1-5H2,(H2,15,16,17)/t8-,10-,11-,14-/m1/s1
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| InChIKey |
WESLZQQBTJAEIN-IDTAVKCVSA-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