General Information of the Compound
| Compound ID |
CP0554437
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| Compound Name |
[[(2R,3S,4R,5R)-4-amino-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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| Structure |
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| Formula |
C10H17N3O10P2
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| Molecular Weight |
401.205
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| Canonical SMILES |
N[C@@H]1[C@H](O)[C@@H](COP(O)(=O)CP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O
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| InChI |
InChI=1S/C10H17N3O10P2/c11-7-8(15)5(3-22-25(20,21)4-24(17,18)19)23-9(7)13-2-1-6(14)12-10(13)16/h1-2,5,7-9,15H,3-4,11H2,(H,20,21)(H,12,14,16)(H2,17,18,19)/t5-,7-,8-,9-/m1/s1
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| InChIKey |
GVCMQAGJENAFLK-ZOQUXTDFSA-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