In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 13 | Yes |
Popular Name: (2S,3S,4R,5S)-1-ethyl-2-(hydroxymethyl)piperidine-3,4,5-triol (2S,3S,4R,5S)-1-ethyl-2-(hydroxy…
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) | -1.78 | -6 | -32.06 | 5 | 5 | 1 | 85 | 192.235 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.78 | -5.37 | -46.18 | 4 | 5 | 0 | 88 | 191.227 | 2 | ↓ |