General Property |
Molceule ID (DB) | EGIN0001674 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 17 compound |
IUPAC Name | 2-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]propanedinitrile |
Formula | C11H7N3O4 |
Mass | 245.191 |
Exact Mass | 245.0436557 |
Composition | C (53.88%), H (2.88%), N (17.14%), O (26.1%) |
Atom Count | 25 |
PI | 0.11 |
Smiles | c1(cc(c(c(c1)OC)O)N(=O)=O)C=C(C#N)C#N |
InChI | 1S/C11H7N3O4/c1-18-10-4-7(2-8(5-12)6-13)3-9(11(10)15)14(16)17/h2-4,15H,1H3 |
InChIKey | CWOXUSIEQFFVBX-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 | 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 |
58857
|
Drug Bank Link | - |
ChemSpider Link | 53051 |
ChEMBL Link | CHEMBL307179 |