| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2009 | 20 | No |
Popular Name: 4-[2-(4-morpholinyl)ethyl]-5-(3-pyridinyl)-4H-1,2,4-triazole-3-thiol 4-[2-(4-morpholinyl)ethyl]-5-(3-…
| 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) | 1.09 | 4.27 | -46.73 | 0 | 6 | -1 | 56 | 290.372 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.37 | 4.43 | -14.88 | 1 | 6 | 0 | 59 | 291.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.09 | 6.6 | -61.37 | 1 | 6 | 0 | 57 | 291.38 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.37 | 6.75 | -56.94 | 2 | 6 | 1 | 60 | 292.388 | 4 | ↓ |
