General Information of the Compound
| Compound ID |
CP0433432
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| Compound Name |
2-Amino-3-(2,4-dihydroxy-pyrimidin-1-yl)-propionic acid(DL-willardiine)
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| Structure |
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| Formula |
C7H9N3O4
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| Molecular Weight |
199.166
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| Canonical SMILES |
NC(Cn1ccc(=O)[nH]c1=O)C(O)=O
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| InChI |
InChI=1S/C7H9N3O4/c8-4(6(12)13)3-10-2-1-5(11)9-7(10)14/h1-2,4H,3,8H2,(H,12,13)(H,9,11,14)
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| InChIKey |
FACUYWPMDKTVFU-UHFFFAOYSA-N
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| CAS |
38062-08-7
19772-76-0
96108-98-4
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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: PT02409, Glutamate receptor 1
Protein ID: PT01414, Glutamate receptor 2
Protein ID: PT03116, Glutamate receptor 3
Protein ID: PT06060, Glutamate receptor 4
Protein ID: PT02200, Glutamate receptor ionotropic, kainate 1