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|---|---|---|---|---|
| KIF | 2-[(3,6-Dihydroxy-2,4-dimethoxyphenyl)thio]acetic acid | 
| Identification | |
|---|---|
| ConjuPepDB ID |   cpd01359  | 
| Smiles | |
| Molecular weight |   947.341  | 
| Molecular formula |   C42H57N7O14S2  | 
| Chemical name | Peptide information | 
| Sequence (one letter) |   KIF  | 
| Length |   3  | 
| Peptide name |   tripeptide  | 
| External ID | |
|---|---|
| CAS number |   372166-54-6  | 
| Other information | |
|---|---|
| Application |   Anticancer therapy, cytotoxic agents  | 
| Additional function |   DNA scission  | 
| Pharmacological class |   anticancer  | 
| Conjugate type |   amide  | 
| Linker |   no  | 
| Small molecule |   2-[(3,6-Dihydroxy-2,4-dimethoxyphenyl)thio]acetic acid  | 
| Small molecule CAS |   133735-47-4  | 
| Structure method |   EPR  | 
| Calculated properties | |
|---|---|
| LogP |   0.15620  | 
| Rotatable bonds |   28  | 
| H bond donor |   11  | 
| H bond acceptor |   16  | 
| Polar surface area (PSA) |   322.44000  | 
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI | 
DNA scission chemistry and EPR studies of four new bis(2,6-dimethoxyhydroquinone-3-mercaptoacetic acid)-peptide conjugates  | 2004  | Song, Yu-Fei  | Australian Journal of Chemistry  | ||