| General Property |
| Molceule ID (DB) | EGIN0003497 |
| Inhibitor Class | Biaryl |
| Molecule Name in Refrence Article | 10a compound |
| IUPAC Name | N-cyclopropyl-3-[3-(cyclopropylmethyl)-4-oxo-3,4-dihydro-1,2,3-benzotriazin-7-yl]-4-methylbenzamide |
| Formula | C22H22N4O2 |
| Mass | 374.4357 |
| Exact Mass | 374.174276 |
| Composition | C (70.57%), H (5.92%), N (14.96%), O (8.55%) |
| Atom Count | 50 |
| PI | 7.41 |
| Smiles | c1(ccc2c(c1)nnn(c2=O)CC1CC1)c1cc(ccc1C)C(=O)NC1CC1 |
| InChI | 1S/C22H22N4O2/c1-13-2-5-16(21(27)23-17-7-8-17)10-19(13)15-6-9-18-20(11-15)24-25-26(22(18)28)12-14-3-
4-14/h2,5-6,9-11,14,17H,3-4,7-8,12H2,1H3,(H,23,27) |
| InChIKey | GURGQFBRXVKIQG-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 | 18789685 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | JNK3 | LCK | CDK2 | cFMS | VEGFR2 | PLK1 | SGK1 | PBMC | HWB | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 24718892 |
| ChEMBL Link | CHEMBL521734 |
