General Information of the Compound
| Compound ID |
CP0479812
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| Compound Name |
4-[(3R,5S)-5-carboxypyrrolidin-3-yl]oxybenzene-1,3-dicarboxylic acid
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| Structure |
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| Formula |
C13H13NO7
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| Molecular Weight |
295.247
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| Canonical SMILES |
OC(=O)[C@@H]1C[C@H](CN1)Oc1ccc(cc1C(O)=O)C(O)=O
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| InChI |
InChI=1S/C13H13NO7/c15-11(16)6-1-2-10(8(3-6)12(17)18)21-7-4-9(13(19)20)14-5-7/h1-3,7,9,14H,4-5H2,(H,15,16)(H,17,18)(H,19,20)/t7-,9+/m1/s1
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| InChIKey |
ISTGMPFAINQQNH-APPZFPTMSA-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: PT01414, Glutamate receptor 2
Protein ID: PT02200, Glutamate receptor ionotropic, kainate 1
Protein ID: PT02970, Glutamate receptor ionotropic, kainate 3