General Information of the Compound
| Compound ID |
CP0469672
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| Compound Name |
(2S)-2-amino-3-[3-oxo-5-[2-(pyridin-4-ylmethyl)tetrazol-5-yl]-1,2-oxazol-4-yl]propanoic acid
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| Structure |
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| Formula |
C13H13N7O4
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| Molecular Weight |
331.292
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| Canonical SMILES |
N[C@@H](Cc1c(O)noc1-c1nnn(Cc2ccncc2)n1)C(O)=O
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| InChI |
InChI=1S/C13H13N7O4/c14-9(13(22)23)5-8-10(24-18-12(8)21)11-16-19-20(17-11)6-7-1-3-15-4-2-7/h1-4,9H,5-6,14H2,(H,18,21)(H,22,23)/t9-/m0/s1
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| InChIKey |
BOAFSTDNNFYOKT-VIFPVBQESA-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: PT02409, Glutamate receptor 1
Protein ID: PT01414, Glutamate receptor 2
Protein ID: PT03116, Glutamate receptor 3
Protein ID: PT06060, Glutamate receptor 4
Protein ID: PT02201, Glutamate receptor ionotropic, kainate 2
Protein ID: PT02970, Glutamate receptor ionotropic, kainate 3