General Information of the Compound
| Compound ID |
CP0437418
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| Compound Name |
(S)-2-Amino-3-(6-bromo-3,5-dioxo-4,5-dihydro-3H-[1,2,4]triazin-2-yl)-propionic acid
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| Structure |
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| Formula |
C6H7BrN4O4
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| Molecular Weight |
279.05
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| Canonical SMILES |
N[C@@H](Cn1nc(Br)c(=O)[nH]c1=O)C(O)=O
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| InChI |
InChI=1S/C6H7BrN4O4/c7-3-4(12)9-6(15)11(10-3)1-2(8)5(13)14/h2H,1,8H2,(H,13,14)(H,9,12,15)/t2-/m0/s1
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| InChIKey |
ZNCDBRBMBIJVRT-REOHCLBHSA-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: PT03542, Glutamate receptor 1
Protein ID: PT01829, Glutamate receptor 2
Protein ID: PT03593, Glutamate receptor 4
Protein ID: PT03594, Glutamate receptor ionotropic, kainate 5