| General Property |
| Molceule ID (DB) | EGIN0003013 |
| Inhibitor Class | Pyrrolo-pyrimidinone |
| Molecule Name in Refrence Article | 26d compound |
| IUPAC Name | (5Z)-4-[(3-chloro-4-fluorophenyl)amino]-5-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one |
| Formula | C19H15ClFN5O |
| Mass | 383.807 |
| Exact Mass | 383.094916 |
| Composition | C (59.46%), H (3.94%), Cl (9.24%), F (4.95%), N (18.25%), O (4.17%) |
| Atom Count | 42 |
| PI | 6.46 |
| Smiles | C1(=Cc2[nH]c(cc2C)C)/c2c(NC1=O)ncnc2Nc1cc(c(cc1)F)Cl |
| InChI | 1S/C19H15ClFN5O/c1-9-5-10(2)24-15(9)7-12-16-17(22-8-23-18(16)26-19(12)27)25-11-3-4-14(21)13(20)6-11/
h3-8,24H,1-2H3,(H2,22,23,25,26,27)/b12-7- |
| InChIKey | YFDRVUYGJJBGOU-GHXNOFRVSA-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 | 12127526 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PDGFR | VEGFR2/Flk-1/KDR | EGFR | ALL |
| Pub Chem Link |
5329232
|
| Drug Bank Link | - |
| ChemSpider Link | 4486383 |
| ChEMBL Link | CHEMBL68920 |
