| General Property |
| Molceule ID (DB) | EGIN0004425 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 6n |
| IUPAC Name | N-[3-chloro-4-(3-methoxyphenoxy)phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine |
| Formula | C19H15ClN4O2 |
| Mass | 366.801 |
| Exact Mass | 366.0883535 |
| Composition | C (62.21%), H (4.12%), Cl (9.67%), N (15.27%), O (8.72%) |
| Atom Count | 41 |
| PI | 9.61 |
| Smiles | c1(c2[nH]ccc2ncn1)Nc1ccc(c(c1)Cl)Oc1cc(ccc1)OC |
| InChI | 1S/C19H15ClN4O2/c1-25-13-3-2-4-14(10-13)26-17-6-5-12(9-15(17)20)24-19-18-16(7-8-21-18)22-11-23-19/h2
-11,21H,1H3,(H,22,23,24) |
| InChIKey | NKUFCHJXONJOLU-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 |
56851593
|
| Drug Bank Link | - |
| ChemSpider Link | 28481047 |
| ChEMBL Link | CHEMBL1921813 |
