General Property |
Molceule ID (DB) | EGIN0000506 |
Inhibitor Class | Thiazolidinone |
Molecule Name in Refrence Article | 4 compound |
IUPAC Name | 2-[(E)-2-[(4-chlorophenyl)methylidene]hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one |
Formula | C10H8ClN3OS |
Mass | 253.708 |
Exact Mass | 253.0076603 |
Composition | C (47.34%), H (3.18%), Cl (13.97%), N (16.56%), O (6.31%), S (12.64%) |
Atom Count | 24 |
PI | 6.62 |
Smiles | c1c(ccc(c1)Cl)/C=N/NC1=NC(=O)CS1 |
InChI | 1S/C10H8ClN3OS/c11-8-3-1-7(2-4-8)5-12-14-10-13-9(15)6-16-10/h1-5H,6H2,(H,13,14,15)/b12-5+ |
InChIKey | KHBZUTKCIKDFSN-LFYBBSHMSA-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 |
5718913
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Drug Bank Link | - |
ChemSpider Link | 4655258 |
ChEMBL Link | CHEMBL589823 |