| General Property |
| Molceule ID (DB) | EGIN0000981 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 15 compound |
| IUPAC Name | 3-({5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl}amino)phenol |
| Formula | C14H14N4O |
| Mass | 254.2872 |
| Exact Mass | 254.1167611 |
| Composition | C (66.13%), H (5.55%), N (22.03%), O (6.29%) |
| Atom Count | 33 |
| PI | 7.89 |
| Smiles | n1cnc2c(c1Nc1cc(ccc1)O)c(c([nH]2)C)C |
| InChI | 1S/C14H14N4O/c1-8-9(2)17-13-12(8)14(16-7-15-13)18-10-4-3-5-11(19)6-10/h3-7,19H,1-2H3,(H2,15,16,17,18
) |
| InChIKey | YVRPTYQSCAYFMF-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 | 8691423 |
| 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 |
10706114
|
| Drug Bank Link | - |
| ChemSpider Link | 8881455 |
| ChEMBL Link | CHEMBL74778 |
