In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 20 | Yes |
Popular Name: [(3S)-3-(hydroxymethyl)-1-piperidyl]-[5-(3-hydroxyprop-1-ynyl)-3-pyridyl]methanone [(3S)-3-(hydroxymethyl)-1-piperi…
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 | 0.73 | -14.36 | 2 | 5 | 0 | 74 | 274.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.