| General Property |
| Molceule ID (DB) | EGIN0002020 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 22 compound |
| IUPAC Name | (2R)-1-(morpholin-4-yl)-2-[(4-{[1-(1,3-thiazol-2-ylmethyl)-1H-indazol-5-yl]amino}quinazolin-5-yl)oxy]propan-1-one |
| Formula | C26H25N7O3S |
| Mass | 515.587 |
| Exact Mass | 515.1739584 |
| Composition | C (60.57%), H (4.89%), N (19.02%), O (9.31%), S (6.22%) |
| Atom Count | 62 |
| PI | 9.64 |
| Smiles | c1ccc2c(c1O[C@H](C)C(=O)N1CCOCC1)c(ncn2)Nc1cc2c(cc1)n(nc2)Cc1sccn1 |
| InChI | 1S/C26H25N7O3S/c1-17(26(34)32-8-10-35-11-9-32)36-22-4-2-3-20-24(22)25(29-16-28-20)31-19-5-6-21-18(13
-19)14-30-33(21)15-23-27-7-12-37-23/h2-7,12-14,16-17H,8-11,15H2,1H3,(H,28,29,31)/t17-/m1/s1 |
| InChIKey | RZPOCZHUFDCVQZ-QGZVFWFLSA-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 | 18313293 |
| 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 |
16118310
|
| Drug Bank Link | - |
| ChemSpider Link | 17275516 |
| ChEMBL Link | CHEMBL257411 |
