| General Property |
| Molceule ID (DB) | EGIN0004231 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 3dd compound |
| IUPAC Name | 2-({4-[(3-bromophenyl)amino]pyrido[4,3-d]pyrimidin-7-yl}(methyl)amino)acetic acid |
| Formula | C16H14BrN5O2 |
| Mass | 388.219 |
| Exact Mass | 387.0330874 |
| Composition | C (49.5%), H (3.63%), Br (20.58%), N (18.04%), O (8.24%) |
| Atom Count | 38 |
| PI | 4.57 |
| Smiles | n1cnc(c2c1cc(nc2)N(CC(=O)O)C)Nc1cc(ccc1)Br |
| InChI | 1S/C16H14BrN5O2/c1-22(8-15(23)24)14-6-13-12(7-18-14)16(20-9-19-13)21-11-4-2-3-10(17)5-11/h2-7,9H,8H2
,1H3,(H,23,24)(H,19,20,21) |
| InChIKey | GYZRHMIPWQOSOA-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 | 4485489 |
| ChEMBL Link | CHEMBL126903 |
