| General Property |
| Molceule ID (DB) | EGIN0004373 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | NVP-BKM120 |
| IUPAC Name | 5-[2,6-bis(morpholin-4-yl)pyrimidin-4-yl]-4-(trifluoromethyl)pyridin-2-amine |
| Formula | C18H21F3N6O2 |
| Mass | 410.3935 |
| Exact Mass | 410.1678086 |
| Composition | C (52.68%), H (5.16%), F (13.89%), N (20.48%), O (7.8%) |
| Atom Count | 50 |
| PI | No isoelectric point. |
| Smiles | c1(cc(ncc1c1cc(nc(n1)N1CCOCC1)N1CCOCC1)N)C(F)(F)F |
| InChI | 1S/C18H21F3N6O2/c19-18(20,21)13-9-15(22)23-11-12(13)14-10-16(26-1-5-28-6-2-26)25-17(24-14)27-3-7-29-
8-4-27/h9-11H,1-8H2,(H2,22,23) |
| InChIKey | CWHUFRVAEUJCEF-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 | 22065080 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | P110alpha | P110beta | P110gamma | P110delta | P110alpha H1047R | P110a E545K | P110a E542K | Protein kinases Fak | KDR | PKA | PKB | PDK1 | HER-1 | c-Met | IGF1 | Eph-B4 | FGFR3 | Ret | Tek | B-Raf V599E | c-Abl | c-Src | Jak-2 | mTOR | ALL |
| Pub Chem Link |
16654980
|
| Drug Bank Link | - |
| ChemSpider Link | 17588300 |
| ChEMBL Link | - |
