| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 15 | No |
Popular Name: [1-[(2S,6S)-2,6-dimethylthiomorpholin-4-yl]cyclopentyl]methanamine [1-[(2S,6S)-2,6-dimethylthiomorp…
| 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) | 1.73 | 4.42 | -47.27 | 3 | 2 | 1 | 31 | 229.413 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 5.97 | -120.82 | 4 | 2 | 2 | 32 | 230.421 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
