| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2010 | 18 | No |
Popular Name: 4-propyl-5-(4-propyl-1-piperidyl)-1,2,4-triazole-3-thiol 4-propyl-5-(4-propyl-1-piperidyl…
| 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) | 3.14 | 11.25 | -9.95 | 1 | 4 | 0 | 37 | 268.43 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 11.37 | -45.37 | 0 | 4 | -1 | 34 | 267.422 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 11.47 | -42.24 | 1 | 4 | 0 | 35 | 268.43 | 5 | ↓ |
