General Information of the Compound
| Compound ID |
CP0407306
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| Compound Name |
(2S)-2-amino-4-[hydroxy-[hydroxy-(4-methylsulfonylphenyl)methyl]phosphoryl]butanoic acid
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| Structure |
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| Formula |
C12H18NO7PS
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| Molecular Weight |
351.317
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)C(O)P(O)(=O)CC[C@H](N)C(O)=O
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| InChI |
InChI=1S/C12H18NO7PS/c1-22(19,20)9-4-2-8(3-5-9)12(16)21(17,18)7-6-10(13)11(14)15/h2-5,10,12,16H,6-7,13H2,1H3,(H,14,15)(H,17,18)/t10-,12?/m0/s1
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| InChIKey |
OEKGPRKVGMSCTI-NUHJPDEHSA-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
Protein ID: PT02199, Metabotropic glutamate receptor 4
Protein ID: PT02744, Metabotropic glutamate receptor 6
Protein ID: PT01311, Metabotropic glutamate receptor 7
Protein ID: PT02739, Metabotropic glutamate receptor 8