| General Property |
| Molceule ID (DB) | EGIN0003461 |
| Inhibitor Class | Diazepine |
| Molecule Name in Refrence Article | 3u compound |
| IUPAC Name | 9-(2-chlorophenyl)-2,4,5,8-tetraazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),3,6,8,11,13-hexaen-12-amine |
| Formula | C16H12ClN5 |
| Mass | 309.753 |
| Exact Mass | 309.0781231 |
| Composition | C (62.04%), H (3.9%), Cl (11.45%), N (22.61%) |
| Atom Count | 34 |
| PI | 9.11 |
| Smiles | [nH]1c2c(c(nc3c1n[nH]c3)c1ccccc1Cl)cc(cc2)N |
| InChI | 1S/C16H12ClN5/c17-12-4-2-1-3-10(12)15-11-7-9(18)5-6-13(11)21-16-14(20-15)8-19-22-16/h1-8H,18H2,(H2,1
9,21,22) |
| InChIKey | LRLOMPHFTKHYKN-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 | PDGFr | FAK | Src | CDK4 | KDR | CDK1 | FGFr | CDK2 | ALL |
| Pub Chem Link |
12043801
|
| Drug Bank Link | - |
| ChemSpider Link | 26365171 |
| ChEMBL Link | CHEMBL1257911 |
