General Property |
Molceule ID (DB) | EGIN0002801 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 17 compound |
IUPAC Name | 2-(4,5-dihydroxy-2,3-dihydro-1H-inden-1-ylidene)propanedinitrile |
Formula | C12H8N2O2 |
Mass | 212.2041 |
Exact Mass | 212.0585775 |
Composition | C (67.92%), H (3.8%), N (13.2%), O (15.08%) |
Atom Count | 24 |
PI | No isoelectric point. |
Smiles | c1(c(ccc2c1CCC2=C(C#N)C#N)O)O |
InChI | 1S/C12H8N2O2/c13-5-7(6-14)8-1-2-10-9(8)3-4-11(15)12(10)16/h3-4,15-16H,1-2H2 |
InChIKey | QNMCUDUCYPYEQM-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 | 1676428 |
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 |
5328755
|
Drug Bank Link | - |
ChemSpider Link | 4485917 |
ChEMBL Link | CHEMBL57300 |