General Information of the Compound
| Compound ID |
CP0564785
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| Compound Name |
[[(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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| Structure |
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| Formula |
C10H17N3O9P2
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| Molecular Weight |
385.206
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| Canonical SMILES |
Nc1ccn([C@H]2C[C@H](O)[C@@H](COP(O)(=O)CP(O)(O)=O)O2)c(=O)n1
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| InChI |
InChI=1S/C10H17N3O9P2/c11-8-1-2-13(10(15)12-8)9-3-6(14)7(22-9)4-21-24(19,20)5-23(16,17)18/h1-2,6-7,9,14H,3-5H2,(H,19,20)(H2,11,12,15)(H2,16,17,18)/t6-,7+,9+/m0/s1
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| InChIKey |
DYRDWMNLUJYIFG-LKEWCRSYSA-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