| General Property |
| Molceule ID (DB) | EGIN0003995 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 3h compound |
| IUPAC Name | 6,7-diethoxy-N-[3-(1H-pyrazol-3-yl)phenyl]quinazolin-4-amine |
| Formula | C21H21N5O2 |
| Mass | 375.4237 |
| Exact Mass | 375.1695249 |
| Composition | C (67.18%), H (5.64%), N (18.65%), O (8.52%) |
| Atom Count | 49 |
| PI | 9.66 |
| Smiles | c12c(ncnc1cc(c(c2)OCC)OCC)Nc1cc(c2n[nH]cc2)ccc1 |
| InChI | 1S/C21H21N5O2/c1-3-27-19-11-16-18(12-20(19)28-4-2)22-13-23-21(16)25-15-7-5-6-14(10-15)17-8-9-24-26-1
7/h5-13H,3-4H2,1-2H3,(H,24,26)(H,22,23,25) |
| InChIKey | KQEIKIGFBVHSFM-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 | 12190310 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | F16BP | |
| Pub Chem Link |
10287149
|
| Drug Bank Link | - |
| ChemSpider Link | 8462618 |
| ChEMBL Link | CHEMBL125920 |
