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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| RLNF | 1-(2,4-Dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01238 |
| Smiles | |
| Molecular weight | 818.295 |
| Molecular formula | C35H45Cl2FN12O6 |
| Chemical name | Peptide information |
| Sequence (one letter) | RLNF |
| Length | 4 |
| Peptide name | tetrapeptide |
| External ID | |
|---|---|
| CAS number | 851456-22-9 |
| Other information | |
|---|---|
| Application | Anticancer therapy, DNA replication |
| Additional function | inhibition of cyclin-dependent kinase 2 (CDK2) / cyclin A substrate reruitment |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | no |
| Small molecule | 1-(2,4-Dichlorophenyl)-5-methyl-1H-1,2,4-triazole-3-carboxylic acid |
| Small molecule CAS | 103058-79-3 |
| Structure method | 1H NMR, HPLC |
| Calculated properties | |
|---|---|
| LogP | 0.38565 |
| Rotatable bonds | 20 |
| H bond donor | 9 |
| H bond acceptor | 11 |
| Polar surface area (PSA) | 295.19000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
REPLACE: a strategy for iterative design of cyclin-binding groove inhibitors | 2006 | Andrews, Martin J. I.; Kontopidis, George; McInnes, Campbell; Plater, Andy; Innes, Lorraine; Cowan, Angela; Jewsbury, Philip; Fischer, Peter M. | ChemBioChem | ||
