| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2008 | 31 | Yes |
Popular Name: 2-(azepan-1-yl)-N-[[(3R)-1-cyclohexyl-3-piperidyl]methyl]-N-(3-pyridylmethyl)acetamide 2-(azepan-1-yl)-N-[[(3R)-1-cyclo…
| 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) | 3.98 | 0.48 | -93.46 | 2 | 5 | 2 | 42 | 428.665 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.98 | 0.6 | -171.86 | 3 | 5 | 3 | 43 | 429.673 | 7 | ↓ |
