General Property |
Molceule ID (DB) | EGIN0002230 |
Inhibitor Class | Pyridine |
Molecule Name in Refrence Article | SORAFENIB |
IUPAC Name | 4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-N-methylpyridine-2-carboxamide |
Formula | C21H16ClF3N4O3 |
Mass | 464.825 |
Exact Mass | 464.0863027 |
Composition | C (54.26%), H (3.47%), Cl (7.63%), F (12.26%), N (12.05%), O (10.33%) |
Atom Count | 48 |
PI | 6.79 |
Smiles | c1c(ccc(c1C(F)(F)F)Cl)NC(=O)Nc1ccc(cc1)Oc1ccnc(c1)C(=O)NC |
InChI | 1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-
13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31) |
InChIKey | MLDQJTXFUGDVEO-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 | 18849971 |
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 |
216239
|
Drug Bank Link | - |
ChemSpider Link | 187440 |
ChEMBL Link | CHEMBL1336 |