| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | No |
Popular Name: 4-[2-(dimethylamino)-2-methyl-propyl]-5-phenyl-1,2,4-triazole-3-thiol 4-[2-(dimethylamino)-2-methyl-pr…
| 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) | 3.13 | 8.66 | -55.65 | 1 | 4 | 0 | 35 | 276.409 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 6.31 | -47.59 | 0 | 4 | -1 | 34 | 275.401 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 8.58 | -31.53 | 2 | 4 | 1 | 38 | 277.417 | 4 | ↓ |
