General Information of the Compound
| Compound ID |
CP0448451
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| Compound Name |
[hydroxy-(5-nitrothiophen-3-yl)methyl]phosphonic acid
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| Structure |
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| Formula |
C5H6NO6PS
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| Molecular Weight |
239.145
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| Canonical SMILES |
OC(c1csc(c1)[N+]([O-])=O)[P+](O)(O)[O-]
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| InChI |
InChI=1S/C5H6NO6PS/c7-5(13(10,11)12)3-1-4(6(8)9)14-2-3/h1-2,5,7H,(H2,10,11,12)
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| InChIKey |
GYZCVXRKJKVUFF-UHFFFAOYSA-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