In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2011 | 16 | Yes |
Popular Name: 4-[(3S)-3-(hydroxymethyl)-1-piperidyl]pyridine-2-carbonitrile 4-[(3S)-3-(hydroxymethyl)-1-pipe…
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) | 1.10 | 2.7 | -8.7 | 1 | 4 | 0 | 60 | 217.272 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.