| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 16 | Yes |
Popular Name: (2S)-2-(azepan-1-yl)-2-(5-bromo-2-thienyl)ethanamine (2S)-2-(azepan-1-yl)-2-(5-bromo-…
| 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) | 2.97 | 4.46 | -49.06 | 3 | 2 | 1 | 31 | 304.277 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.97 | 6.51 | -132.88 | 4 | 2 | 2 | 32 | 305.285 | 3 | ↓ |
