| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 19 | No |
Popular Name: 5-(4-pyridyl)-4-[[(2S)-tetrahydropyran-2-yl]methyl]-1,2,4-triazole-3-thiol 5-(4-pyridyl)-4-[[(2S)-tetrahydr…
| 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) | 1.88 | 6.88 | -48.8 | 0 | 5 | -1 | 53 | 275.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 6.8 | -12.73 | 1 | 5 | 0 | 56 | 276.365 | 3 | ↓ |
