General Property |
Molceule ID (DB) | EGIN0001659 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 4 compound |
IUPAC Name | 2-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]propanedinitrile |
Formula | C12H10N2O3 |
Mass | 230.2194 |
Exact Mass | 230.0691422 |
Composition | C (62.6%), H (4.38%), N (12.17%), O (20.85%) |
Atom Count | 27 |
PI | 1.47 |
Smiles | c1(cc(c(c(c1)OC)O)OC)C=C(C#N)C#N |
InChI | 1S/C12H10N2O3/c1-16-10-4-8(3-9(6-13)7-14)5-11(17-2)12(10)15/h3-5,15H,1-2H3 |
InChIKey | ZEGOLZJKCSVYBM-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 |
746495
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Drug Bank Link | - |
ChemSpider Link | 652702 |
ChEMBL Link | CHEMBL421877 |