| General Property |
| Molceule ID (DB) | EGIN0001845 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 10c compound |
| IUPAC Name | N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-5-(oxan-4-yloxy)quinazolin-4-amine |
| Formula | C25H23ClN4O3 |
| Mass | 462.928 |
| Exact Mass | 462.1458683 |
| Composition | C (64.86%), H (5.01%), Cl (7.66%), N (12.1%), O (10.37%) |
| Atom Count | 56 |
| PI | 10.01 |
| Smiles | c1(c2c(OC3CCOCC3)cccc2ncn1)Nc1cc(c(OCc2ncccc2)cc1)Cl |
| InChI | 1S/C25H23ClN4O3/c26-20-14-17(7-8-22(20)32-15-18-4-1-2-11-27-18)30-25-24-21(28-16-29-25)5-3-6-23(24)3
3-19-9-12-31-13-10-19/h1-8,11,14,16,19H,9-10,12-13,15H2,(H,28,29,30) |
| InChIKey | NGKDXIDMJWVNHU-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 | 16055332 |
| 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 |
44403429
|
| Drug Bank Link | - |
| ChemSpider Link | 23261678 |
| ChEMBL Link | CHEMBL193578 |
