| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 19th, 2006 | 21 | No |
Popular Name: 2-[(4-methyl-1-piperidyl)methyl]-5-(p-tolyl)-4H-1,2,4-triazole-3-thione 2-[(4-methyl-1-piperidyl)methyl]…
| 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) | 3.18 | 12.02 | -36.51 | 2 | 4 | 1 | 38 | 303.455 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 9.63 | -9.38 | 1 | 4 | 0 | 37 | 302.447 | 3 | ↓ |
