General Property |
Molceule ID (DB) | EGIN0002942 |
Inhibitor Class | Dianilino-phthalimide |
Molecule Name in Refrence Article | 19 compound |
IUPAC Name | 5,6-bis(cyclohexylamino)-2,3-dihydro-1H-isoindole-1,3-dione |
Formula | C20H27N3O2 |
Mass | 341.4473 |
Exact Mass | 341.2103271 |
Composition | C (70.35%), H (7.97%), N (12.31%), O (9.37%) |
Atom Count | 52 |
PI | 6.18 |
Smiles | N1C(=O)c2c(C1=O)cc(c(c2)NC1CCCCC1)NC1CCCCC1 |
InChI | 1S/C20H27N3O2/c24-19-15-11-17(21-13-7-3-1-4-8-13)18(12-16(15)20(25)23-19)22-14-9-5-2-6-10-14/h11-14,
21-22H,1-10H2,(H,23,24,25) |
InChIKey | XRWICMQUHCDJPG-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 | RKC | c-Src | EGFR | v-ab1 | PKA | ALL |
Pub Chem Link |
10450005
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Drug Bank Link | - |
ChemSpider Link | 8625422 |
ChEMBL Link | CHEMBL266969 |