In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 18 | No |
Popular Name: 2-[[(3R)-3-ethyl-1-piperidyl]methyl]-5-propyl-4H-1,2,4-triazole-3-thione 2-[[(3R)-3-ethyl-1-piperidyl]met…
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) | 2.28 | 10.55 | -36.85 | 2 | 4 | 1 | 38 | 269.438 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.