| General Property |
| Molceule ID (DB) | EGIN0004422 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 6q |
| IUPAC Name | N-{3-methyl-4-[(6-methylpyridin-3-yl)oxy]phenyl}-5H-pyrrolo[3,2-d]pyrimidin-4-amine |
| Formula | C19H17N5O |
| Mass | 331.3712 |
| Exact Mass | 331.1433102 |
| Composition | C (68.87%), H (5.17%), N (21.13%), O (4.83%) |
| Atom Count | 42 |
| PI | 9.72 |
| Smiles | c1(c2[nH]ccc2ncn1)Nc1ccc(c(c1)C)Oc1ccc(nc1)C |
| InChI | 1S/C19H17N5O/c1-12-9-14(24-19-18-16(7-8-20-18)22-11-23-19)4-6-17(12)25-15-5-3-13(2)21-10-15/h3-11,20
H,1-2H3,(H,22,23,24) |
| InChIKey | SZVAKAGCAKQORO-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 | 22003817 |
| 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 |
56849556
|
| Drug Bank Link | - |
| ChemSpider Link | 28481049 |
| ChEMBL Link | CHEMBL1923002 |
