| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 14 | No |
Popular Name: (2R)-3-[(1,1-dioxothian-4-yl)amino]-2-methyl-propanenitrile (2R)-3-[(1,1-dioxothian-4-yl)ami…
| 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) | 0.42 | 1.77 | -71.64 | 2 | 4 | 1 | 75 | 217.314 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 0.58 | -15.84 | 1 | 4 | 0 | 70 | 216.306 | 3 | ↓ |
