| General Property |
| Molceule ID (DB) | EGIN0000628 |
| Inhibitor Class | Benzamidine |
| Molecule Name in Refrence Article | 3b compound |
| IUPAC Name | N-(3-chlorophenyl)-6,7-dimethoxy-2,2-dimethyl-1,2-dihydroquinazolin-4-amine |
| Formula | C18H20ClN3O2 |
| Mass | 345.823 |
| Exact Mass | 345.1244046 |
| Composition | C (62.52%), H (5.83%), Cl (10.25%), N (12.15%), O (9.25%) |
| Atom Count | 44 |
| PI | 8.92 |
| Smiles | CC1(Nc2c(cc(c(c2)OC)OC)C(=N1)Nc1cccc(c1)Cl)C |
| InChI | 1S/C18H20ClN3O2/c1-18(2)21-14-10-16(24-4)15(23-3)9-13(14)17(22-18)20-12-7-5-6-11(19)8-12/h5-10,21H,1
-4H3,(H,20,22) |
| InChIKey | PUABVLLUNPGSTN-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 | 15186837 |
| 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 |
10337646
|
| Drug Bank Link | - |
| ChemSpider Link | 8513105 |
| ChEMBL Link | CHEMBL306104 |
