| General Property |
| Molceule ID (DB) | EGIN0001753 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 52 compound |
| IUPAC Name | 6-(2,6-dichlorophenyl)-2-{[3-(hydroxymethyl)phenyl]amino}-8-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
| Formula | C21H16Cl2N4O2 |
| Mass | 427.283 |
| Exact Mass | 426.0650312 |
| Composition | C (59.03%), H (3.77%), Cl (16.59%), N (13.11%), O (7.49%) |
| Atom Count | 45 |
| PI | 7.32 |
| Smiles | OCc1cccc(Nc2ncc3cc(c(=O)n(c3n2)C)c2c(Cl)cccc2Cl)c1 |
| InChI | 1S/C21H16Cl2N4O2/c1-27-19-13(9-15(20(27)29)18-16(22)6-3-7-17(18)23)10-24-21(26-19)25-14-5-2-4-12(8-1
4)11-28/h2-10,28H,11H2,1H3,(H,24,25,26) |
| InChIKey | ZIQFYVPVJZEOFS-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 | 9703473 | 10974196 | |
| 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 | DB08339 |
| ChemSpider Link | 394719 |
| ChEMBL Link | CHEMBL327127 |
