| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 16 | No |
Popular Name: 5-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-4-ethyl-1,2,4-triazole-3-thiol 5-[(2R,6R)-2,6-dimethylmorpholin…
| 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) | 0.82 | 7.74 | -10.11 | 1 | 5 | 0 | 46 | 242.348 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 7.83 | -43.1 | 0 | 5 | -1 | 43 | 241.34 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
