| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 9 | No |
S-Propyl 1-propanesulfinothioate
S-propyl propane-1-sulfinothioate
| 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) | 2.53 | -1.01 | -9.26 | 0 | 1 | 0 | 17 | 166.311 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q95PM0-3-E | Rhodesain (cluster #3 Of 3), Eukaryotic | Eukaryotes | 4440 | 0.83 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q95PM0_TRYBR | Q95PM0 | Rhodesain, Trybr | 4440 | 0.83 | Binding ≤ 10μM |
