| General Property |
| Molceule ID (DB) | EGIN0003462 |
| Inhibitor Class | Diazepine |
| Molecule Name in Refrence Article | 3v compound |
| IUPAC Name | N-[9-(2-chlorophenyl)-2,4,5,8-tetraazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),3,6,8,11,13-hexaen-12-yl]acetamide |
| Formula | C18H14ClN5O |
| Mass | 351.79 |
| Exact Mass | 351.0886878 |
| Composition | C (61.46%), H (4.01%), Cl (10.08%), N (19.91%), O (4.55%) |
| Atom Count | 39 |
| PI | 7.47 |
| Smiles | [nH]1c2c(c(nc3c1n[nH]c3)c1ccccc1Cl)cc(cc2)NC(=O)C |
| InChI | 1S/C18H14ClN5O/c1-10(25)21-11-6-7-15-13(8-11)17(12-4-2-3-5-14(12)19)22-16-9-20-24-18(16)23-15/h2-9H,
1H3,(H,21,25)(H2,20,23,24) |
| InChIKey | SVZUZSDHGKVQNU-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 | 20832307 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | FAK | CDK4 | PDGFr | KDR | CDK1 | CDK2 | FGFr | Src | ALL |
| Pub Chem Link |
52943201
|
| Drug Bank Link | - |
| ChemSpider Link | 26365786 |
| ChEMBL Link | CHEMBL1257912 |
