| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2011 | 16 | Yes |
Popular Name: (2S)-2-amino-4-[(4R)-4-ethylazepan-1-yl]-2-methyl-butanenitrile (2S)-2-amino-4-[(4R)-4-ethylazep…
| 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) | 2.35 | 5.86 | -46.03 | 3 | 3 | 1 | 54 | 224.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 3.94 | -5.2 | 2 | 3 | 0 | 53 | 223.364 | 4 | ↓ |
