| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | No |
Popular Name: (1R,2S)-1-(5-bromo-2-thienyl)-1-(1,4-thiazepan-4-yl)propan-2-amine (1R,2S)-1-(5-bromo-2-thienyl)-1-…
| 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) | 2.62 | 5.54 | -49.52 | 3 | 2 | 1 | 31 | 336.344 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 5.25 | -2.58 | 2 | 2 | 0 | 29 | 335.336 | 3 | ↓ |
