| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 17 | Yes |
Popular Name: [3-fluoro-4-[(4-methylpiperazin-1-yl)methyl]phenyl]methanamine [3-fluoro-4-[(4-methylpiperazin-…
| 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) | 0.91 | 4.03 | -89.82 | 4 | 3 | 2 | 35 | 239.338 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 1.17 | -4.98 | 2 | 3 | 0 | 32 | 237.322 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 3.94 | -91.34 | 4 | 3 | 2 | 35 | 239.338 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 1.57 | -49.84 | 3 | 3 | 1 | 34 | 238.33 | 3 | ↓ |
