| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2009 | 21 | Yes |
Popular Name: 4-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methylamino]methyl]benzonitrile 4-[[(4-methoxy-3,5-dimethyl-2-py…
| 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) | 2.68 | 7.36 | -53.92 | 2 | 4 | 1 | 63 | 282.367 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 6.52 | -37.19 | 2 | 4 | 1 | 59 | 282.367 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 6.01 | -8.3 | 1 | 4 | 0 | 58 | 281.359 | 5 | ↓ |
