| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 20 | Yes |
Popular Name: 2-[4-[[(3-fluorophenyl)methylamino]methyl]phenoxy]acetonitrile 2-[4-[[(3-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) | 2.88 | 8.33 | -56.7 | 2 | 3 | 1 | 50 | 271.315 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 6.97 | -9.95 | 1 | 3 | 0 | 45 | 270.307 | 6 | ↓ |
