| General Property |
| Molceule ID (DB) | EGIN0003224 |
| Inhibitor Class | Pyrrolo-pyrimidine |
| Molecule Name in Refrence Article | 4b compound |
| IUPAC Name | 5-phenyl-7-[(3S)-pyrrolidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C16H17N5 |
| Mass | 279.3397 |
| Exact Mass | 279.1483956 |
| Composition | C (68.79%), H (6.13%), N (25.07%) |
| Atom Count | 38 |
| PI | No isoelectric point. |
| Smiles | c12c(c(cn1[C@H]1CCNC1)c1ccccc1)c(ncn2)N |
| InChI | 1S/C16H17N5/c17-15-14-13(11-4-2-1-3-5-11)9-21(12-6-7-18-8-12)16(14)20-10-19-15/h1-5,9-10,12,18H,6-8H
2,(H2,17,19,20)/t12-/m0/s1 |
| InChIKey | XNIBNLVJQPSPNT-LBPRGKRZSA-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 | 11277536 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Src | |
| Pub Chem Link |
57010398
|
| Drug Bank Link | - |
| ChemSpider Link | 13741016 |
| ChEMBL Link | CHEMBL168829 |
