General Information of the Compound
| Compound ID |
CP0358589
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| Compound Name |
2-[7-[3-(aminomethyl)pyrrol-1-yl]-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl]acetic acid
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| Structure |
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| Formula |
C15H13N5O6
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| Molecular Weight |
359.298
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| Canonical SMILES |
NCc1ccn(c1)-c1cc2n(CC(O)=O)c(=O)c(=O)[nH]c2cc1[N+]([O-])=O
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| InChI |
InChI=1S/C15H13N5O6/c16-5-8-1-2-18(6-8)11-4-10-9(3-12(11)20(25)26)17-14(23)15(24)19(10)7-13(21)22/h1-4,6H,5,7,16H2,(H,17,23)(H,21,22)
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| InChIKey |
LUIPVVRVNKNJEK-UHFFFAOYSA-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: PT01518, Glutamate receptor ionotropic, kainate 1
Protein ID: PT02754, Glutamate receptor ionotropic, kainate 2