General Property |
Molceule ID (DB) | EGIN0001653 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 25 compound |
IUPAC Name | 2-[(3,4-dihydroxy-5-methylphenyl)methylidene]propanedinitrile |
Formula | C11H8N2O2 |
Mass | 200.1934 |
Exact Mass | 200.0585775 |
Composition | C (66%), H (4.03%), N (13.99%), O (15.98%) |
Atom Count | 23 |
PI | No isoelectric point. |
Smiles | c1(cc(c(c(c1)O)O)C)C=C(C#N)C#N |
InChI | 1S/C11H8N2O2/c1-7-2-8(3-9(5-12)6-13)4-10(14)11(7)15/h2-4,14-15H,1H3 |
InChIKey | NBBJLHJHLMMMKM-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 | 7902440 |
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 |
9899125
|
Drug Bank Link | - |
ChemSpider Link | 8074782 |
ChEMBL Link | CHEMBL116423 |