| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2011 | 34 | No |
Popular Name: 3-(4-tert-butylphenyl)-4-octadecyl-1H-1,2,4-triazole-5-thione 3-(4-tert-butylphenyl)-4-octadec…
| 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) | 9.56 | 22.21 | -8.82 | 1 | 3 | 0 | 34 | 485.826 | 19 | ↓ |
| Mid Mid (pH 6-8) | 9.71 | 22.32 | -46.67 | 0 | 3 | -1 | 31 | 484.818 | 19 | ↓ |
