General Information of the Compound
| Compound ID |
CP0470960
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| Compound Name |
9-[(2S,5S)-4,4-difluoro-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one
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| Structure |
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| Formula |
C10H10F2N4O3
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| Molecular Weight |
272.211
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| Canonical SMILES |
OC[C@@H]1O[C@@H](CC1(F)F)n1cnc2c1nc[nH]c2=O
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| InChI |
InChI=1S/C10H10F2N4O3/c11-10(12)1-6(19-5(10)2-17)16-4-15-7-8(16)13-3-14-9(7)18/h3-6,17H,1-2H2,(H,13,14,18)/t5-,6-/m0/s1
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| InChIKey |
RXZNKDXOYZZVIK-WDSKDSINSA-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