In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 22 | Yes |
Popular Name: (2R)-2-(2-chlorophenyl)-1-piperazin-1-yl-2-(1-piperidyl)ethanone (2R)-2-(2-chlorophenyl)-1-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) | 2.11 | 6.18 | -46.43 | 2 | 4 | 1 | 40 | 322.86 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 4.27 | -5.85 | 1 | 4 | 0 | 36 | 321.852 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 7.96 | -89.25 | 3 | 4 | 2 | 41 | 323.868 | 3 | ↓ |