General Property |
Molceule ID (DB) | EGIN0001686 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 31 compound |
IUPAC Name | (2E)-2-cyano-3-(4-nitrophenyl)prop-2-enoic acid |
Formula | C10H6N2O4 |
Mass | 218.1656 |
Exact Mass | 218.0327567 |
Composition | C (55.05%), H (2.77%), N (12.84%), O (29.33%) |
Atom Count | 22 |
PI | No isoelectric point. |
Smiles | c1(ccc(cc1)N(=O)=O)/C=C(C#N)/C(=O)O |
InChI | 1S/C10H6N2O4/c11-6-8(10(13)14)5-7-1-3-9(4-2-7)12(15)16/h1-5H,(H,13,14)/b8-5+ |
InChIKey | WVRIVHWJJWXSTM-VMPITWQZSA-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 |
5328789
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Drug Bank Link | - |
ChemSpider Link | 4485951 |
ChEMBL Link | CHEMBL309866 |