| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 21st, 2008 | 15 | No |
Popular Name: Boc-(L)-ILEU-aldehyde Boc-(L)-ILEU-aldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 254888-05-6 , [ 87694-55-1 ]
Boc-(L)-ILEU-aldehyde, Boc-L-Isoleucinal
Carbamic acid, [(1S)-1-formyl-2-methylbutyl]-, 1,1-dimethylethyl ester (9CI)
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.36 | 0.98 | -8.83 | 1 | 4 | 0 | 55 | 215.293 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | n.d. | Squarix |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CATK-2-E | Cathepsin K (cluster #2 Of 3), Eukaryotic | Eukaryotes | 250 | 0.62 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CATK_HUMAN | P43235 | Cathepsin K, Human | 250 | 0.62 | Binding ≤ 1μM |
| CATK_HUMAN | P43235 | Cathepsin K, Human | 250 | 0.62 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of Matrix Metalloproteinases | |
| Collagen degradation | |
| Degradation of the extracellular matrix | |
| MHC class II antigen presentation | |
| Trafficking and processing of endosomal TLR |
