General Property |
Molceule ID (DB) | EGIN0000516 |
Inhibitor Class | Thiazolidinone |
Molecule Name in Refrence Article | 14 compound |
IUPAC Name | 2-[(E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one |
Formula | C10H7Br2N3O2S |
Mass | 393.054 |
Exact Mass | 390.8625725 |
Composition | C (30.56%), H (1.8%), Br (40.66%), N (10.69%), O (8.14%), S (8.16%) |
Atom Count | 25 |
PI | 5.96 |
Smiles | c1(c(cc(cc1Br)Br)/C=N/NC1=NC(=O)CS1)O |
InChI | 1S/C10H7Br2N3O2S/c11-6-1-5(9(17)7(12)2-6)3-13-15-10-14-8(16)4-18-10/h1-3,17H,4H2,(H,14,15,16)/b13-3+ |
InChIKey | XNOWWTBMMKXRCZ-QLKAYGNNSA-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 | 19914835 |
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 | 12939113 |
ChEMBL Link | CHEMBL590875 |