| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 19 | No |
Popular Name: 4-[(1S)-2-[[(3R)-1,1-dioxothiolan-3-yl]amino]-1-hydroxy-ethyl]benzonitrile 4-[(1S)-2-[[(3R)-1,1-dioxothiola…
| 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) | 0.19 | 1.1 | -73.64 | 3 | 5 | 1 | 95 | 281.357 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | -0.06 | -16.87 | 2 | 5 | 0 | 90 | 280.349 | 4 | ↓ |
