| General Property |
| Molceule ID (DB) | EGIN0004228 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 3aa compound |
| IUPAC Name | 2-({4-[(3-bromophenyl)amino]pyrido[4,3-d]pyrimidin-7-yl}amino)acetic acid |
| Formula | C15H12BrN5O2 |
| Mass | 374.192 |
| Exact Mass | 373.0174373 |
| Composition | C (48.15%), H (3.23%), Br (21.35%), N (18.72%), O (8.55%) |
| Atom Count | 35 |
| PI | 4.53 |
| Smiles | n1cnc(c2c1cc(nc2)NCC(=O)O)Nc1cc(ccc1)Br |
| InChI | 1S/C15H12BrN5O2/c16-9-2-1-3-10(4-9)21-15-11-6-17-13(18-7-14(22)23)5-12(11)19-8-20-15/h1-6,8H,7H2,(H,
17,18)(H,22,23)(H,19,20,21) |
| InChIKey | DNUPNCOEFDVRHA-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 | 4485486 |
| ChEMBL Link | CHEMBL338175 |
