| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: oxoBLAHcarbonitrile oxoBLAHcarbonitrile
| 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) | 2.82 | 6.75 | -13.19 | 1 | 3 | 0 | 57 | 236.274 | 0 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 4.8 | -49.55 | 0 | 3 | -1 | 60 | 235.266 | 0 | ↓ |
