In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 20 | Yes |
Popular Name: 3-[4-[2-[(2R)-1-methyl-2-piperidyl]ethyl]piperazin-1-yl]propanoic 3-[4-[2-[(2R)-1-methyl-2-piperid…
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) | 0.95 | 7.84 | -82.68 | 2 | 5 | 1 | 52 | 284.424 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 5.57 | -66.05 | 1 | 5 | 0 | 51 | 283.416 | 6 | ↓ |