| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 18 | Yes |
Popular Name: (2S,4R)-2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-hexanenitrile (2S,4R)-2-(1,3-benzothiazol-2-yl…
| 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) | 2.65 | 7.78 | -15.07 | 0 | 3 | 0 | 54 | 258.346 | 4 | ↓ |
