| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 17 | Yes |
Popular Name: 4-[(1S)-1-hydroxy-2-[[(1R)-2-methoxy-1-methyl-ethyl]amino]ethyl]benzonitrile 4-[(1S)-1-hydroxy-2-[[(1R)-2-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) | 0.98 | 3.03 | -46.92 | 3 | 4 | 1 | 70 | 235.307 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 1.75 | -7.42 | 2 | 4 | 0 | 65 | 234.299 | 6 | ↓ |
