In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 18 | Yes |
Popular Name: (2R)-1-[4-(hydroxymethyl)-1-piperidyl]-2-piperazin-1-yl-propan-1-one (2R)-1-[4-(hydroxymethyl)-1-pipe…
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) | -0.54 | -0.12 | -43.45 | 3 | 5 | 1 | 60 | 256.37 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.54 | -1.48 | -9.59 | 2 | 5 | 0 | 56 | 255.362 | 3 | ↓ |