| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | Yes |
Popular Name: 2-[4-[[(2-chlorophenyl)methylamino]methyl]phenoxy]acetonitrile 2-[4-[[(2-chlorophenyl)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) | 3.37 | 8.7 | -48.95 | 2 | 3 | 1 | 50 | 287.77 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 7.34 | -9.25 | 1 | 3 | 0 | 45 | 286.762 | 6 | ↓ |
