| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: 3-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]propan-1-amine 3-[4-[(3-fluoro-4-methoxy-phenyl…
| 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) | 0.86 | 4 | -112.82 | 4 | 4 | 2 | 45 | 283.391 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 1.35 | -6.34 | 2 | 4 | 0 | 42 | 281.375 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 3.98 | -100.05 | 4 | 4 | 2 | 45 | 283.391 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 1.72 | -47.43 | 3 | 4 | 1 | 43 | 282.383 | 6 | ↓ |
