| General Property |
| Molceule ID (DB) | EGIN0004423 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 6p |
| IUPAC Name | N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine |
| Formula | C18H14ClN5O |
| Mass | 351.79 |
| Exact Mass | 351.0886878 |
| Composition | C (61.46%), H (4.01%), Cl (10.08%), N (19.91%), O (4.55%) |
| Atom Count | 39 |
| PI | 9.61 |
| Smiles | c1(c2[nH]ccc2ncn1)Nc1ccc(c(c1)Cl)OCc1ccccn1 |
| InChI | 1S/C18H14ClN5O/c19-14-9-12(24-18-17-15(6-8-21-17)22-11-23-18)4-5-16(14)25-10-13-3-1-2-7-20-13/h1-9,1
1,21H,10H2,(H,22,23,24) |
| InChIKey | SJMHQTPAHZSCGB-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 |
56849555
|
| Drug Bank Link | - |
| ChemSpider Link | 28481587 |
| ChEMBL Link | CHEMBL1923001 |
