General Property |
Molceule ID (DB) | EGIN0001684 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 29 compound |
IUPAC Name | (2E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoic acid |
Formula | C12H12N2O2 |
Mass | 216.2359 |
Exact Mass | 216.0898776 |
Composition | C (66.65%), H (5.59%), N (12.96%), O (14.8%) |
Atom Count | 28 |
PI | 4.03 |
Smiles | c1(ccc(cc1)N(C)C)/C=C(C#N)/C(=O)O |
InChI | 1S/C12H12N2O2/c1-14(2)11-5-3-9(4-6-11)7-10(8-13)12(15)16/h3-7H,1-2H3,(H,15,16)/b10-7+ |
InChIKey | CXZXLLVNQYUMAW-JXMROGBWSA-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 |
1550166
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Drug Bank Link | - |
ChemSpider Link | 1266856 |
ChEMBL Link | CHEMBL77436 |