General Property |
Molceule ID (DB) | EGIN0004436 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 6g |
IUPAC Name | 8-[(1H-indazol-5-yl)amino]-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
Formula | C23H23N7O3 |
Mass | 445.4738 |
Exact Mass | 445.1862376 |
Composition | C (62.01%), H (5.2%), N (22.01%), O (10.77%) |
Atom Count | 56 |
PI | 10.34 |
Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1ccc2[nH]ncc2c1 |
InChI | 1S/C23H23N7O3/c31-23-30(5-1-4-29-6-8-32-9-7-29)20-11-17-19(12-21(20)33-23)24-14-25-22(17)27-16-2-3-1
8-15(10-16)13-26-28-18/h2-3,10-14H,1,4-9H2,(H,26,28)(H,24,25,27) |
InChIKey | VOAPURHNWAYKRM-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0004436.png) | Structure Backbone | ![](./frame/f_EGIN0004436.png) |
|
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 | 22818848 |
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 |
-
|
Drug Bank Link | - |
ChemSpider Link | 28509263 |
ChEMBL Link | - |