[English] 日本語
![](img/lk-miru.gif)
- ChemComp-53I: (2E)-3-{5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxyphenyl... -
+
Open data
-
Basic information
Entry | ![]() |
---|---|
Name | Name: ( Synonyms: (R,E)-3-(5-((2,4-diaminopyrimidin-5-yl)methyl)-2,3-dimethoxyphenyl)-1-(1-(2-methylprop-1-en-1-yl)phthalazin-2(1H)-yl)pr |
-Chemical information
Composition | |||||||
---|---|---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 53I / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4ELH | ||||||
History |
| ||||||
![]() | ![]() ![]() ![]() ![]() ![]() ![]() |
-
Structure visualization
Structure viewer | Molecule: ![]() ![]() |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | (OpenEye OEToolkits 1.7.6 | ( | |
---|
-PDB entries
Showing all 1 items
![](data/pdb/img/4elh.jpg)
PDB-4elh:
Structure-activity relationship guides enantiomeric preference among potent inhibitors of B. anthracis dihydrofolate reductase