General Property |
Molceule ID (DB) | EGIN0000194 |
Inhibitor Class | Diphenyl-amine |
Molecule Name in Refrence Article | 14f compound |
IUPAC Name | N'-[(1E)-(2R)-oxolan-2-ylmethylidene]-2-[(4-{N'-[(1E)-(2R)-oxolan-2-ylmethylidene]hydrazinecarbonyl}phenyl)amino]benzohydrazide |
Formula | C24H27N5O4 |
Mass | 449.5023 |
Exact Mass | 449.2063044 |
Composition | C (64.13%), H (6.05%), N (15.58%), O (14.24%) |
Atom Count | 60 |
PI | 6.02 |
Smiles | c1c(c(ccc1)C(=O)N/N=C/[C@@H]1OCCC1)Nc1ccc(cc1)C(=O)N/N=C/[C@H]1CCCO1 |
InChI | 1S/C24H27N5O4/c30-23(28-25-15-19-5-3-13-32-19)17-9-11-18(12-10-17)27-22-8-2-1-7-21(22)24(31)29-26-16
-20-6-4-14-33-20/h1-2,7-12,15-16,19-20,27H,3-6,13-14H2,(H,28,30)(H,29,31)/b25-15+,26-16+/t19-,20-/m1
/s1 |
InChIKey | UDELFUBQXDTBSJ-IWTOYXBHSA-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 | 20580136 |
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 | - |