| General Property |
| Molceule ID (DB) | EGIN0004424 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 6o |
| IUPAC Name | N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-5H-pyrrolo[3,2-d]pyrimidin-4-amine |
| Formula | C19H14ClFN4O |
| Mass | 368.792 |
| Exact Mass | 368.084017 |
| Composition | C (61.88%), H (3.83%), Cl (9.61%), F (5.15%), N (15.19%), O (4.34%) |
| Atom Count | 40 |
| PI | 9.61 |
| Smiles | c1(c2[nH]ccc2ncn1)Nc1ccc(c(c1)Cl)OCc1cccc(c1)F |
| InChI | 1S/C19H14ClFN4O/c20-15-9-14(25-19-18-16(6-7-22-18)23-11-24-19)4-5-17(15)26-10-12-2-1-3-13(21)8-12/h1
-9,11,22H,10H2,(H,23,24,25) |
| InChIKey | QWAHCSOEUYGXDS-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 |
56851594
|
| Drug Bank Link | - |
| ChemSpider Link | 28481048 |
| ChEMBL Link | CHEMBL1923000 |
