General Information of the Compound
| Compound ID |
CP0374457
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| Compound Name |
9-[(2R,5R)-4-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-1H-purin-6-one
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| Structure |
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| Formula |
C10H9FN4O3
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| Molecular Weight |
252.205
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| Canonical SMILES |
OC[C@H]1O[C@H](C=C1F)n1cnc2c1nc[nH]c2=O
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| InChI |
InChI=1S/C10H9FN4O3/c11-5-1-7(18-6(5)2-16)15-4-14-8-9(15)12-3-13-10(8)17/h1,3-4,6-7,16H,2H2,(H,12,13,17)/t6-,7-/m1/s1
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| InChIKey |
PGUVAFVRRFGJHY-RNFRBKRXSA-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