| General Property |
| Molceule ID (DB) | EGIN0000978 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 12 compound |
| IUPAC Name | N-(3-fluorophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C14H13FN4 |
| Mass | 256.2782 |
| Exact Mass | 256.1124246 |
| Composition | C (65.61%), H (5.11%), F (7.41%), N (21.86%) |
| Atom Count | 32 |
| PI | 10.41 |
| Smiles | n1cnc2c(c1Nc1cc(ccc1)F)c(c([nH]2)C)C |
| InChI | 1S/C14H13FN4/c1-8-9(2)18-13-12(8)14(17-7-16-13)19-11-5-3-4-10(15)6-11/h3-7H,1-2H3,(H2,16,17,18,19) |
| InChIKey | QQBKALJLRAEGBT-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 | c-Src | PKC alpha | v-Abl | ALL |
| Pub Chem Link |
10729749
|
| Drug Bank Link | - |
| ChemSpider Link | 8905082 |
| ChEMBL Link | CHEMBL308582 |
