| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: 3-[(3-bromo-4-methoxy-phenyl)methyl-ethyl-amino]propanenitrile 3-[(3-bromo-4-methoxy-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) | 2.37 | 8.2 | -53.03 | 1 | 3 | 1 | 37 | 298.204 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 6.07 | -8.37 | 0 | 3 | 0 | 36 | 297.196 | 6 | ↓ |
