| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 20 | Yes |
Popular Name: 4-[(1S)-1-hydroxy-2-[methyl(3-pyridylmethyl)amino]ethyl]benzonitrile 4-[(1S)-1-hydroxy-2-[methyl(3-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) | 1.07 | 4.04 | -10.03 | 1 | 4 | 0 | 60 | 267.332 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 6.35 | -53.23 | 2 | 4 | 1 | 61 | 268.34 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 4.51 | -38.58 | 2 | 4 | 1 | 61 | 268.34 | 5 | ↓ |
