| General Property |
| Molceule ID (DB) | EGIN0003074 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 6c compound |
| IUPAC Name | N-(3-chlorophenyl)-7-methoxy-6-(pent-4-yn-1-yloxy)quinazolin-4-amine |
| Formula | C20H18ClN3O2 |
| Mass | 367.829 |
| Exact Mass | 367.1087545 |
| Composition | C (65.31%), H (4.93%), Cl (9.64%), N (11.42%), O (8.7%) |
| Atom Count | 44 |
| PI | 10.27 |
| Smiles | c1(c(cc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)OC)OCCCC#C |
| InChI | 1S/C20H18ClN3O2/c1-3-4-5-9-26-19-11-16-17(12-18(19)25-2)22-13-23-20(16)24-15-8-6-7-14(21)10-15/h1,6-
8,10-13H,4-5,9H2,2H3,(H,22,23,24) |
| InChIKey | BHLKTDQPSGRIAY-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 | 19969465 |
| 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 |
46230531
|
| Drug Bank Link | - |
| ChemSpider Link | 24644006 |
| ChEMBL Link | CHEMBL592713 |
