In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 18 | Yes |
Popular Name: 2-[2-[(3S)-3-hydroxy-1-piperidyl]-2-oxo-ethyl]-1H-pyridazine-3,6-dione 2-[2-[(3S)-3-hydroxy-1-piperidyl…
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) | -0.85 | -2.82 | -49.43 | 1 | 7 | -1 | 98 | 252.25 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.85 | -3.54 | -16.4 | 2 | 7 | 0 | 96 | 253.258 | 2 | ↓ |