| General Property |
| Molceule ID (DB) | EGIN0001975 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 36 compound |
| IUPAC Name | 4-(5-chloro-6-fluoro-1H-indol-3-yl)-7-methoxy-6-[3-(morpholin-4-yl)propoxy]quinazoline |
| Formula | C24H24ClFN4O3 |
| Mass | 470.924 |
| Exact Mass | 470.1520966 |
| Composition | C (61.21%), H (5.14%), Cl (7.53%), F (4.03%), N (11.9%), O (10.19%) |
| Atom Count | 57 |
| PI | 10.57 |
| Smiles | c1(c(cc2c(c1)ncnc2c1c2cc(c(cc2[nH]c1)F)Cl)OCCCN1CCOCC1)OC |
| InChI | 1S/C24H24ClFN4O3/c1-31-22-12-21-16(10-23(22)33-6-2-3-30-4-7-32-8-5-30)24(29-14-28-21)17-13-27-20-11-
19(26)18(25)9-15(17)20/h9-14,27H,2-8H2,1H3 |
| InChIKey | HXKNWYUOIAOBMC-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 | 17981366 |
| 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 |
11619763
|
| Drug Bank Link | - |
| ChemSpider Link | 9794511 |
| ChEMBL Link | CHEMBL474524 |
