In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 20 | Yes |
Popular Name: 1-(2-chlorophenyl)-4-[[(2R)-2-piperidyl]methyl]piperazine 1-(2-chlorophenyl)-4-[[(2R)-2-pi…
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) | 3.24 | 9.82 | -115.91 | 3 | 3 | 2 | 24 | 295.858 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.24 | 6.28 | -2.07 | 1 | 3 | 0 | 19 | 293.842 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.95 | -34.37 | 2 | 3 | 1 | 23 | 294.85 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.66 | -31.04 | 2 | 3 | 1 | 20 | 294.85 | 3 | ↓ |