| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 17 | Yes |
Popular Name: 3-[(2S)-2-hydroxy-3-(prop-2-ynylamino)propoxy]benzonitrile 3-[(2S)-2-hydroxy-3-(prop-2-ynyl…
| 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) | 0.67 | 2.15 | -10.94 | 2 | 4 | 0 | 65 | 230.267 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 3.52 | -51.65 | 3 | 4 | 1 | 70 | 231.275 | 6 | ↓ |
