| General Property |
| Molceule ID (DB) | EGIN0004454 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 5q |
| IUPAC Name | 8-[(2-hydroxyphenyl)amino]-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
| Formula | C22H23N5O4 |
| Mass | 421.4491 |
| Exact Mass | 421.1750042 |
| Composition | C (62.7%), H (5.5%), N (16.62%), O (15.19%) |
| Atom Count | 54 |
| PI | 8.13 |
| Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1c(cccc1)O |
| InChI | 1S/C22H23N5O4/c28-19-5-2-1-4-16(19)25-21-15-12-18-20(13-17(15)23-14-24-21)31-22(29)27(18)7-3-6-26-8-
10-30-11-9-26/h1-2,4-5,12-14,28H,3,6-11H2,(H,23,24,25) |
| InChIKey | VMIQKNBDZRNRNG-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 | 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 28522145 |
| ChEMBL Link | - |
