In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: 3-[[4-(hydroxymethyl)-1-piperidyl]methyl]furan-2-carboxylic 3-[[4-(hydroxymethyl)-1-piperidy…
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) | 0.64 | 4.43 | -42.73 | 2 | 5 | 0 | 78 | 239.271 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 2.15 | -52.74 | 1 | 5 | -1 | 77 | 238.263 | 4 | ↓ |