| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 29 | Yes |
Popular Name: 4-[(3R,5S)-4-[2-[(1S)-isochroman-1-yl]ethyl]-3,5-dimethyl-piperazin-1-yl]benzamide 4-[(3R,5S)-4-[2-[(1S)-isochroman…
| 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) | 3.24 | 8.62 | -47.61 | 3 | 5 | 1 | 60 | 394.539 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 6.57 | -11.03 | 2 | 5 | 0 | 59 | 393.531 | 5 | ↓ |
