General Information of the Compound
| Compound ID |
CP0459918
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| Compound Name |
(2S,4R)-2-amino-4-[3-(diethylamino)-3-oxopropyl]pentanedioic acid
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| Structure |
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| Formula |
C12H22N2O5
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| Molecular Weight |
274.317
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| Canonical SMILES |
CCN(CC)C(=O)CC[C@H](C[C@H](N)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C12H22N2O5/c1-3-14(4-2)10(15)6-5-8(11(16)17)7-9(13)12(18)19/h8-9H,3-7,13H2,1-2H3,(H,16,17)(H,18,19)/t8-,9+/m1/s1
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| InChIKey |
ZGOACODHVDVPFP-BDAKNGLRSA-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: PT02201, Glutamate receptor ionotropic, kainate 2
Protein ID: PT02970, Glutamate receptor ionotropic, kainate 3