In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 16 | Yes |
Popular Name: (2R)-2-(2-chlorophenyl)-2-piperazin-1-yl-acetonitrile (2R)-2-(2-chlorophenyl)-2-pipera…
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) | 1.64 | 4.83 | -48.46 | 2 | 3 | 1 | 44 | 236.726 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 3.42 | -5.37 | 1 | 3 | 0 | 39 | 235.718 | 2 | ↓ |