General Property |
Molceule ID (DB) | EGIN0001672 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 18 compound |
IUPAC Name | 2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]propanedinitrile |
Formula | C11H7BrN2O2 |
Mass | 279.089 |
Exact Mass | 277.9690901 |
Composition | C (47.34%), H (2.53%), Br (28.63%), N (10.04%), O (11.47%) |
Atom Count | 23 |
PI | 0.92 |
Smiles | c1(cc(c(c(c1)OC)O)Br)C=C(C#N)C#N |
InChI | 1S/C11H7BrN2O2/c1-16-10-4-7(2-8(5-13)6-14)3-9(12)11(10)15/h2-4,15H,1H3 |
InChIKey | RMTVRMJDCJSEMW-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 |
57591
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Drug Bank Link | - |
ChemSpider Link | 51917 |
ChEMBL Link | CHEMBL77298 |