3D model is for representation purpose only.
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|---|---|---|---|---|
| GLA | 1,5,9-Triazacyclododecane-1-acetic acid | 
| Identification | |
|---|---|
| ConjuPepDB ID |   cpd00603  | 
| Smiles | |
| Inchi Key |   InChIKey=YWJOFQFKYAJLLX-ZEQRLZLVSA-N  | 
| Molecular weight |   627.421  | 
| Molecular formula |   C31H57N5O8  | 
| Chemical name | Peptide information | 
| Sequence (one letter) |   GLA  | 
| Length |   3  | 
| Peptide name |   tripeptide  | 
| External ID | |
|---|---|
| CAS number |   1367281-22-8  | 
| Other information | |
|---|---|
| Application |   Synthesis  | 
| Additional function |   DNA cleaving, metal-free  | 
| Conjugate type |   amine  | 
| Linker |   no  | 
| Small molecule |   1,5,9-Triazacyclododecane-1-acetic acid  | 
| Small molecule CAS |   1334610-50-2  | 
| Small molecule structure |   | 
| Structure method |   1H- and 13C-NMR  | 
| Calculated properties | |
|---|---|
| LogP |   1.84105  | 
| Rotatable bonds |   13  | 
| H bond donor |   2  | 
| H bond acceptor |   6  | 
| Polar surface area (PSA) |   146.82000  | 
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI | 
Synthesis of [12]aneN3-dipeptide conjugates as metal-free DNA nucleases  | 2012  | Li, Zhi-Fen; Chen, Hua-Long; Zhang, Li-Jun; Lu, Zhong-Lin  | Bioorganic & Medicinal Chemistry Letters  | ||