| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2010 | 48 | No |
Popular Name: 26305-03-3; C00773; Pepstatin 26305-03-3; C00773; Pepstatin
Find On: PubMed — Wikipedia — Google
CAS Number: 26305-03-3
None
| 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) | 1.82 | 6.54 | -56.36 | 7 | 14 | -1 | 226 | 684.896 | 22 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PEPA-1-E | Pepsin A (cluster #1 Of 2), Eukaryotic | Eukaryotes | 7 | 0.24 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PEPA_PIG | P00791 | Pepsin A, Pig | 7 | 0.24 | Binding ≤ 1μM |
| PEPA_PIG | P00791 | Pepsin A, Pig | 7 | 0.24 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.