| General Property |
| Molceule ID (DB) | EGIN0004426 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 6m |
| IUPAC Name | N-[3-chloro-4-(3-methylphenoxy)phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine |
| Formula | C19H15ClN4O |
| Mass | 350.802 |
| Exact Mass | 350.0934388 |
| Composition | C (65.05%), H (4.31%), Cl (10.11%), N (15.97%), O (4.56%) |
| Atom Count | 40 |
| PI | 9.61 |
| Smiles | c1(c2[nH]ccc2ncn1)Nc1ccc(c(c1)Cl)Oc1cc(ccc1)C |
| InChI | 1S/C19H15ClN4O/c1-12-3-2-4-14(9-12)25-17-6-5-13(10-15(17)20)24-19-18-16(7-8-21-18)22-11-23-19/h2-11,
21H,1H3,(H,22,23,24) |
| InChIKey | HHAXMCRVXIYOJR-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 |
56851592
|
| Drug Bank Link | - |
| ChemSpider Link | 28480189 |
| ChEMBL Link | CHEMBL1922999 |
