| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 19th, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(1R)-1-(methylcarbamoyl)pentyl]hexanamide (2S)-2-amino-N-[(1R)-1-(methylca…
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| 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) | 1.26 | 1.98 | -47.18 | 5 | 5 | 1 | 86 | 258.386 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 1.68 | -13.14 | 4 | 5 | 0 | 84 | 257.378 | 9 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TPP2-1-E | Tripeptidyl Aminopeptidase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9000 | 0.39 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TPP2_RAT | Q64560 | Tripeptidyl Aminopeptidase, Rat | 9000 | 0.39 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Antigen processing: Ubiquitination & Proteasome degradation |
