| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2010 | 19 | No |
Popular Name: 5-(4-tert-butyl-1-piperidyl)-4-propyl-1,2,4-triazole-3-thiol 5-(4-tert-butyl-1-piperidyl)-4-p…
| 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) | 3.22 | 11.21 | -9.75 | 1 | 4 | 0 | 37 | 282.457 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 11.46 | -42.02 | 1 | 4 | 0 | 35 | 282.457 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 11.33 | -45.19 | 0 | 4 | -1 | 34 | 281.449 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 11.52 | -47.04 | 2 | 4 | 1 | 38 | 283.465 | 4 | ↓ |
