In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 21 | Yes |
Popular Name: [5-(4-hydroxybut-1-ynyl)-3-pyridyl]-[(2R)-2-(hydroxymethyl)-1-piperidyl]methanone [5-(4-hydroxybut-1-ynyl)-3-pyrid…
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) | -0.25 | 2.86 | -9.72 | 2 | 5 | 0 | 74 | 288.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.