| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2010 | 21 | Yes |
Popular Name: 4-[(2S)-2-hydroxy-3-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]propoxy]benzonitrile 4-[(2S)-2-hydroxy-3-[methyl-[[(2…
| 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) | 1.51 | 5.65 | -43.93 | 2 | 5 | 1 | 67 | 291.371 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 3.33 | -9.3 | 1 | 5 | 0 | 66 | 290.363 | 7 | ↓ |
