| General Property |
| Molceule ID (DB) | EGIN0004995 |
| Inhibitor Class | - |
| Molecule Name in Refrence Article | 13 |
| IUPAC Name | N‐(3‐chloro‐4‐methoxyphenyl)‐9H‐purin‐6‐amine |
| Formula | C12H10ClN5O |
| Mass | 275.694 |
| Exact Mass | 275.057387674 |
| Composition | C (52.28%), H (3.66%), Cl (12.86%), N (25.4%), O (5.8%) |
| Atom Count | 29 |
| PI | 7.02 |
| Smiles | [H]N(C1=NC([H])=NC2=C1N=C([H])N2[H])C1=C([H])C([H])=C(OC([H])([H])[H])C(Cl)=C1[H] |
| InChI | 1S/C12H10ClN5O/c1-19-9-3-2-7(4-8(9)13)18-12-10-11(15-5-14-10)16-6-17-12/h2-6H,1H3,(H2,14,15,16,17,18
) |
| InChIKey | DWMZQQLIMBCANJ-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 | 22607878 |
| 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 |
16422691
|
| Drug Bank Link | - |
| ChemSpider Link | 17486811 |
| ChEMBL Link | - |
