| General Property |
| Molceule ID (DB) | EGIN0001762 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 7a (S-Enantiomer) |
| IUPAC Name | (2S)-2-[(5R)-4-amino-5-phenyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-7-yl]-2-phenylethan-1-ol |
| Formula | C20H20N4O |
| Mass | 332.399 |
| Exact Mass | 332.1637113 |
| Composition | C (72.27%), H (6.06%), N (16.86%), O (4.81%) |
| Atom Count | 45 |
| PI | 10.88 |
| Smiles | c1(ncnc2c1[C@H](CN2[C@@H](c1ccccc1)CO)c1ccccc1)N |
| InChI | 1S/C20H20N4O/c21-19-18-16(14-7-3-1-4-8-14)11-24(20(18)23-13-22-19)17(12-25)15-9-5-2-6-10-15/h1-10,13
,16-17,25H,11-12H2,(H2,21,22,23)/t16-,17-/m1/s1 |
| InChIKey | BCPCKGLIPLIYKJ-IAGOWNOFSA-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 | 11277535 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Src | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
