| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 19 | Yes |
Popular Name: 2-[(2S)-2-hydroxy-3-[[(1R)-2-methoxy-1-methyl-ethyl]amino]propoxy]benzonitrile 2-[(2S)-2-hydroxy-3-[[(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) | 1.16 | 2.78 | -47.21 | 3 | 5 | 1 | 79 | 265.333 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 1.55 | -12.68 | 2 | 5 | 0 | 75 | 264.325 | 8 | ↓ |
