General Information of the Compound
| Compound ID |
CP0372931
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| Compound Name |
(3R,4S,5R)-2-[6-[(6-hydroxy-2-bicyclo[2.2.1]heptanyl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
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| Structure |
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| Formula |
C17H23N5O5
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| Molecular Weight |
377.401
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| Canonical SMILES |
OC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(NC3CC4CC(O)C3C4)ncnc12
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| InChI |
InChI=1S/C17H23N5O5/c23-4-11-13(25)14(26)17(27-11)22-6-20-12-15(18-5-19-16(12)22)21-9-2-7-1-8(9)10(24)3-7/h5-11,13-14,17,23-26H,1-4H2,(H,18,19,21)/t7?,8?,9?,10?,11-,13-,14-,17?/m1/s1
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| InChIKey |
OYIHAKZUASUWGW-DXECBOILSA-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