| General Property |
| Molceule ID (DB) | EGIN0004589 |
| Inhibitor Class | Triazine |
| Molecule Name in Refrence Article | 1b |
| IUPAC Name | N-(4-chlorophenyl)-1-{[4-(4-chlorophenyl)-6-hydroxy-1,3,5-triazin-2-yl]sulfanyl}formamide |
| Formula | C16H10Cl2N4O2S |
| Mass | 393.247 |
| Exact Mass | 391.9901517 |
| Composition | C (48.87%), H (2.56%), Cl (18.03%), N (14.25%), O (8.14%), S (8.15%) |
| Atom Count | 35 |
| PI | 6.55 |
| Smiles | n1c(nc(nc1c1ccc(cc1)Cl)SC(=O)Nc1ccc(cc1)Cl)O |
| InChI | 1S/C16H10Cl2N4O2S/c17-10-3-1-9(2-4-10)13-20-14(23)22-15(21-13)25-16(24)19-12-7-5-11(18)6-8-12/h1-8H,
(H,19,24)(H,20,21,22,23) |
| InChIKey | XJUQZPUCZKXLGM-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 | 22227214 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
-
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
