General Information of the Compound
| Compound ID |
CP0553778
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| Compound Name |
1-[(1S,2R,3R,4R,5S)-2-fluoro-4,5-dihydroxy-3-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
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| Structure |
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| Formula |
C10H13FN2O5
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| Molecular Weight |
260.221
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| Canonical SMILES |
OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H]([C@@H]1F)n1ccc(=O)[nH]c1=O
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| InChI |
InChI=1S/C10H13FN2O5/c11-6-4(3-14)8(16)9(17)7(6)13-2-1-5(15)12-10(13)18/h1-2,4,6-9,14,16-17H,3H2,(H,12,15,18)/t4-,6+,7+,8+,9-/m0/s1
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| InChIKey |
OMOMTUPBMGJBRC-FUABNLTJSA-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