General Property |
Molceule ID (DB) | EGIN0002293 |
Inhibitor Class | Benzylidene |
Molecule Name in Refrence Article | 28 compound |
IUPAC Name | (4E)-1-methyl-2,5-dimethylidene-3-(2-phenylethyl)-4-(phenylmethylidene)imidazolidine |
Formula | C21H22N2 |
Mass | 302.4128 |
Exact Mass | 302.1782987 |
Composition | C (83.4%), H (7.33%), N (9.26%) |
Atom Count | 45 |
PI | No isoelectric point. |
Smiles | c1(=Cc2ccccc2)/n(c(=C)n(c1=C)C)CCc1ccccc1 |
InChI | 1S/C21H22N2/c1-17-21(16-20-12-8-5-9-13-20)23(18(2)22(17)3)15-14-19-10-6-4-7-11-19/h4-13,16H,1-2,14-1
5H2,3H3/b21-16+ |
InChIKey | MSHYJTWTBOSYJV-LTGZKZEYSA-N |
2D Structure | | Structure Backbone | |
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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 |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |