| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 19 | No |
Popular Name: 4-(2,2-dimethoxyethyl)-5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol 4-(2,2-dimethoxyethyl)-5-(4-meth…
| 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) | 1.95 | 6.97 | -12.62 | 1 | 5 | 0 | 52 | 279.365 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 6.82 | -48.84 | 0 | 5 | -1 | 49 | 278.357 | 5 | ↓ |
