| General Property |
| Molceule ID (DB) | EGIN0004218 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 3q compound |
| IUPAC Name | 4-N-(3-bromophenyl)-7-N-[2-(morpholin-4-yl)ethyl]pyrido[4,3-d]pyrimidine-4,7-diamine |
| Formula | C19H21BrN6O |
| Mass | 429.314 |
| Exact Mass | 428.096022 |
| Composition | C (53.16%), H (4.93%), Br (18.61%), N (19.58%), O (3.73%) |
| Atom Count | 48 |
| PI | 10.81 |
| Smiles | n1cnc(c2c1cc(nc2)NCCN1CCOCC1)Nc1cc(ccc1)Br |
| InChI | 1S/C19H21BrN6O/c20-14-2-1-3-15(10-14)25-19-16-12-22-18(11-17(16)23-13-24-19)21-4-5-26-6-8-27-9-7-26/
h1-3,10-13H,4-9H2,(H,21,22)(H,23,24,25) |
| InChIKey | RHIKOEXNOGXDPV-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 | 9397172 |
| 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 | 4485476 |
| ChEMBL Link | CHEMBL128987 |
