General Property |
Molceule ID (DB) | EGIN0002931 |
Inhibitor Class | Dianilino-phthalimide |
Molecule Name in Refrence Article | 8 compound |
IUPAC Name | 5,6-bis({[4-(diethylamino)phenyl]amino})-2,3-dihydro-1H-isoindole-1,3-dione |
Formula | C28H33N5O2 |
Mass | 471.5939 |
Exact Mass | 471.2634253 |
Composition | C (71.31%), H (7.05%), N (14.85%), O (6.79%) |
Atom Count | 68 |
PI | 8.06 |
Smiles | N1C(=O)c2c(C1=O)cc(c(c2)Nc1ccc(N(CC)CC)cc1)Nc1ccc(N(CC)CC)cc1 |
InChI | 1S/C28H33N5O2/c1-5-32(6-2)21-13-9-19(10-14-21)29-25-17-23-24(28(35)31-27(23)34)18-26(25)30-20-11-15-
22(16-12-20)33(7-3)8-4/h9-18,29-30H,5-8H2,1-4H3,(H,31,34,35) |
InChIKey | ZIUKVZLABPRJTA-UHFFFAOYSA-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 | 8151612 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | c-Src | v-ab1 | PKA | RKC | EGFR | ALL |
Pub Chem Link |
10434923
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Drug Bank Link | - |
ChemSpider Link | 8610349 |
ChEMBL Link | CHEMBL8223 |