General Property |
Molceule ID (DB) | EGIN0002270 |
Inhibitor Class | Benzylidene |
Molecule Name in Refrence Article | 5 compound |
IUPAC Name | (5E)-5-[(3-hydroxyphenyl)methylidene]-1-(2-phenylethyl)imidazolidine-2,4-dione; dichlorane |
Formula | C18H16Cl2N2O3 |
Mass | 379.237 |
Exact Mass | 378.0537978 |
Composition | C (57.01%), H (4.25%), Cl (18.7%), N (7.39%), O (12.66%) |
Atom Count | 41 |
PI | No isoelectric point. |
Smiles | C1(=Cc2cccc(c2)O)/N(C(=O)NC1=O)CCc1ccccc1.ClCl |
InChI | 1S/C18H16N2O3.Cl2/c21-15-8-4-7-14(11-15)12-16-17(22)19-18(23)20(16)10-9-13-5-2-1-3-6-13;1-2/h1-8,11-
12,21H,9-10H2,(H,19,22,23);/b16-12+; |
InChIKey | HUMUASZSGIVPQF-CLNHMMGSSA-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 | 19268405 |
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 | 22933 |
ChEMBL Link | - |