| General Property |
| Molceule ID (DB) | EGIN0005062 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 20 |
| IUPAC Name | 3,5â€dibromoâ€Nâ€{4â€[(3â€bromophenyl)amino]quinazolinâ€6â€yl}â€2â€hydroxybenzamide |
| Formula | C21H13Br3N4O2 |
| Mass | 593.066 |
| Exact Mass | 589.858863621 |
| Composition | C (42.53%), H (2.21%), Br (40.42%), N (9.45%), O (5.4%) |
| Atom Count | 43 |
| PI | 5.05 |
| Smiles | [H]OC1=C(C([H])=C(Br)C([H])=C1Br)C(=O)N([H])C1=C([H])C2=C(N=C([H])N=C2N([H])C2=C([H])C(Br)=C([H])C([H])=C2[H])C([H])=C1[H] |
| InChI | 1S/C21H13Br3N4O2/c22-11-2-1-3-13(6-11)27-20-15-9-14(4-5-18(15)25-10-26-20)28-21(30)16-7-12(23)8-17(2
4)19(16)29/h1-10,29H,(H,28,30)(H,25,26,27) |
| InChIKey | MMTRWQYIYUAJFF-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 | 23936329 |
| 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 | - |
| ChEMBL Link | - |
