General Property |
Molceule ID (DB) | EGIN0001669 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 14 compound |
IUPAC Name | 2-(2H-1,3-benzodioxol-5-ylmethylidene)propanedinitrile |
Formula | C11H6N2O2 |
Mass | 198.1775 |
Exact Mass | 198.0429274 |
Composition | C (66.67%), H (3.05%), N (14.14%), O (16.15%) |
Atom Count | 21 |
PI | No isoelectric point. |
Smiles | c1(ccc2c(c1)OCO2)C=C(C#N)C#N |
InChI | 1S/C11H6N2O2/c12-5-9(6-13)3-8-1-2-10-11(4-8)15-7-14-10/h1-4H,7H2 |
InChIKey | AWMFEYQOEQDZKO-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 2552117 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
18091
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Drug Bank Link | - |
ChemSpider Link | 17088 |
ChEMBL Link | CHEMBL78005 |