| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2006 | 9 | No |
Popular Name: 2-Ethyl-1-hexanethiol 2-Ethyl-1-hexanethiol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 7341-17-5 , [7341-17-5]
| 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) | 3.83 | 1.38 | -0.74 | 0 | 0 | 0 | 0 | 146.299 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.83 | 0.43 | -43.41 | 0 | 0 | -1 | 0 | 145.291 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.