| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-3-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-amino-propanoic (2S)-3-[(4aS,8aS)-3,4,4a,5,6,7,8…
None
| 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) | -0.72 | 5.27 | -43.22 | 3 | 4 | 0 | 71 | 226.32 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.72 | 5.58 | -83.04 | 4 | 4 | 1 | 72 | 227.328 | 3 | ↓ |
