In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2011 | 17 | Yes |
Popular Name: (4,4-dimethyl-1-piperidyl)-(3-hydroxy-2-pyridyl)methanone (4,4-dimethyl-1-piperidyl)-(3-hy…
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) | 1.89 | 5.93 | -52.81 | 0 | 4 | -1 | 56 | 233.291 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 4.92 | -9.9 | 1 | 4 | 0 | 53 | 234.299 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 3.94 | -28.45 | 1 | 4 | 0 | 58 | 234.299 | 1 | ↓ |