| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | No |
Popular Name: [(1R,2S)-2-methyl-1-(1,4-thiazepan-4-yl)cyclohexyl]methanamine [(1R,2S)-2-methyl-1-(1,4-thiazep…
| 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) | 2.02 | 4.75 | -45.83 | 3 | 2 | 1 | 31 | 243.44 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 6.19 | -119.41 | 4 | 2 | 2 | 32 | 244.448 | 2 | ↓ |
