General Information of the Compound
| Compound ID |
CP0376768
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[[1-[(2S)-2-amino-2-carboxyethyl]-2,4-dioxothieno[3,2-d]pyrimidin-3-yl]methyl]thiophene-2-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H13N3O6S2
|
||||||||||||||||||
| Molecular Weight |
395.418
|
||||||||||||||||||
| Canonical SMILES |
N[C@@H](Cn1c2ccsc2c(=O)n(Cc2ccsc2C(O)=O)c1=O)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H13N3O6S2/c16-8(13(20)21)6-17-9-2-4-26-11(9)12(19)18(15(17)24)5-7-1-3-25-10(7)14(22)23/h1-4,8H,5-6,16H2,(H,20,21)(H,22,23)/t8-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ASIMEDXKJYQTKT-QMMMGPOBSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02200, Glutamate receptor ionotropic, kainate 1
Protein ID: PT02201, Glutamate receptor ionotropic, kainate 2
Protein ID: PT02970, Glutamate receptor ionotropic, kainate 3