In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2009 | 18 | Yes |
Popular Name: 2-[(3S)-3-cyano-1-piperidyl]-6-methyl-pyridine-3-carboxylic 2-[(3S)-3-cyano-1-piperidyl]-6-m…
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) | 1.28 | 6.82 | -49.93 | 1 | 5 | 0 | 81 | 245.282 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 6.52 | -49.91 | 0 | 5 | -1 | 80 | 244.274 | 2 | ↓ |