| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 21 | Yes |
Popular Name: 2-[(2S)-2-hydroxy-3-[[(2S)-tetrahydropyran-2-yl]methylamino]propoxy]benzonitrile 2-[(2S)-2-hydroxy-3-[[(2S)-tetra…
| 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) | 1.37 | 4.2 | -49.8 | 3 | 5 | 1 | 79 | 291.371 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 2.73 | -13.02 | 2 | 5 | 0 | 75 | 290.363 | 7 | ↓ |
