| General Property |
| Molceule ID (DB) | EGIN0000681 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 7a compound |
| IUPAC Name | (4R,4aS)-N-(3-bromophenyl)-4H,4aH-pyrido[3,4-d]pyrimidin-4-amine |
| Formula | C13H11BrN4 |
| Mass | 303.157 |
| Exact Mass | 302.016709 |
| Composition | C (51.5%), H (3.66%), Br (26.36%), N (18.48%) |
| Atom Count | 29 |
| PI | 9.42 |
| Smiles | [C@H]12C(=NC=N[C@H]2Nc2cc(ccc2)Br)C=NC=C1 |
| InChI | 1S/C13H11BrN4/c14-9-2-1-3-10(6-9)18-13-11-4-5-15-7-12(11)16-8-17-13/h1-8,11,13,18H/t11-,13+/m1/s1 |
| InChIKey | JDOBGCPBIMXTBY-YPMHNXCESA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 8627606 |
| 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 | - |
| ChEMBL Link | CHEMBL51265 |
