| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 20 | Yes |
Popular Name: 3-[[(2-bromo-4-fluoro-phenyl)methyl-methyl-amino]methyl]benzonitrile 3-[[(2-bromo-4-fluoro-phenyl)met…
| 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) | 3.77 | 11.2 | -46.94 | 1 | 2 | 1 | 28 | 334.212 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 8.87 | -6.57 | 0 | 2 | 0 | 27 | 333.204 | 4 | ↓ |
