| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 22 | Yes |
Popular Name: (2S)-2-(azepan-1-yl)-2-(6-methoxy-2-naphthyl)ethanamine (2S)-2-(azepan-1-yl)-2-(6-methox…
| 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) | 3.36 | 8.47 | -136.75 | 4 | 3 | 2 | 41 | 300.446 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 6.37 | -50.31 | 3 | 3 | 1 | 40 | 299.438 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 8.11 | -37.4 | 3 | 3 | 1 | 40 | 299.438 | 4 | ↓ |
