In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 19 | Yes |
Popular Name: 2-[4-(2-cyano-2-methyl-propanoyl)piperazin-1-yl]-N-ethyl-acetamide 2-[4-(2-cyano-2-methyl-propanoyl…
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) | 0.48 | 1.58 | -20.44 | 1 | 6 | 0 | 76 | 266.345 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 3.74 | -62.18 | 2 | 6 | 1 | 78 | 267.353 | 4 | ↓ |