| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 15 | No |
Popular Name: (2S,6S)-4-[(4R)-azepan-4-yl]-2,6-dimethyl-thiomorpholine (2S,6S)-4-[(4R)-azepan-4-yl]-2,6…
| 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) | 1.55 | 5.37 | -41.38 | 2 | 2 | 1 | 20 | 229.413 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.55 | 6.94 | -104.79 | 3 | 2 | 2 | 21 | 230.421 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
