| General Property |
| Molceule ID (DB) | EGIN0003691 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 10n compound |
| IUPAC Name | 4-N-(3-bromophenyl)-2-methyl-6-N-[2-(morpholin-4-yl)ethyl]pyrido[3,4-d]pyrimidine-4,6-diamine |
| Formula | C20H23BrN6O |
| Mass | 443.34 |
| Exact Mass | 442.111672 |
| Composition | C (54.18%), H (5.23%), Br (18.02%), N (18.96%), O (3.61%) |
| Atom Count | 51 |
| PI | 10.9 |
| Smiles | c1(c2c(nc(n1)C)cnc(c2)NCCN1CCOCC1)Nc1cc(Br)ccc1 |
| InChI | 1S/C20H23BrN6O/c1-14-24-18-13-23-19(22-5-6-27-7-9-28-10-8-27)12-17(18)20(25-14)26-16-4-2-3-15(21)11-
16/h2-4,11-13H,5-10H2,1H3,(H,22,23)(H,24,25,26) |
| InChIKey | YKLBZCPQLOXMBM-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 | 9513602 |
| 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 | 4485546 |
| ChEMBL Link | CHEMBL165228 |
