| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 20 | No |
Popular Name: 4-[3-(dimethylamino)-2,2-dimethyl-propyl]-5-(4-pyridyl)-1,2,4-triazole-3-thiol 4-[3-(dimethylamino)-2,2-dimethy…
| 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) | 2.19 | 8 | -59.61 | 1 | 5 | 0 | 48 | 291.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 7.61 | -48.84 | 2 | 5 | 1 | 51 | 292.432 | 5 | ↓ |
