| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 28 | Yes |
Popular Name: 3-[4-(2,4-dimethylphenyl)-5-[2-(1-piperidyl)ethylsulfanyl]-1,2,4-triazol-3-yl]pyridine 3-[4-(2,4-dimethylphenyl)-5-[2-(…
| 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) | 4.67 | 14.32 | -40.96 | 1 | 5 | 1 | 48 | 394.568 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 12.1 | -9.85 | 0 | 5 | 0 | 47 | 393.56 | 6 | ↓ |
