| General Property |
| Molceule ID (DB) | EGIN0004198 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 28 compound |
| IUPAC Name | N,1,4,4-tetramethyl-8-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-1H,4H,5H-pyrazolo[4,3-h]quinazoline-3-carboxamide |
| Formula | C25H32N8O |
| Mass | 460.5746 |
| Exact Mass | 460.2699077 |
| Composition | C (65.19%), H (7%), N (24.33%), O (3.47%) |
| Atom Count | 66 |
| PI | 10.96 |
| Smiles | O=C(NC)c1nn(C)c2c1C(Cc1c2nc(nc1)Nc1ccc(cc1)N1CCN(C)CC1)(C)C |
| InChI | 1S/C25H32N8O/c1-25(2)14-16-15-27-24(29-20(16)22-19(25)21(23(34)26-3)30-32(22)5)28-17-6-8-18(9-7-17)3
3-12-10-31(4)11-13-33/h6-9,15H,10-14H2,1-5H3,(H,26,34)(H,27,28,29) |
| InChIKey | RXZMYLDMFYNEIM-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 19603809 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | AKT1 | CDC7 | CHK1 | CK2 | ERK2 | GSK-3 beta | IGF1R | IKK2 | IKKi | IR | LYN | MAPKAPK2 | MET | P38a | P38ß | PAK4 | PDK1 | PKA alpha | PKC beta | PLK1 | STLK2 | TRKA | VEGFR2 | Zap70 | AurA | NEK6 | NIM | FGFR1 | CDK7/H | CDK4/D1 | RET | LCK | CDK5/p25 | SULU1 | CDK2/E | CDK1/B | AurB | CDK2/A | c-Abl | TRKA | PDGFR | C-KIT | VEGFR3 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 16788113 |
| ChEMBL Link | CHEMBL564829 |
