| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | Yes |
Popular Name: 2-[2-[[(4-fluorophenyl)methylamino]methyl]phenoxy]acetonitrile 2-[2-[[(4-fluorophenyl)methylami…
| 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) | 2.85 | 8.39 | -48.78 | 2 | 3 | 1 | 50 | 271.315 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 7.01 | -8.92 | 1 | 3 | 0 | 45 | 270.307 | 6 | ↓ |
