| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 27 | Yes |
Popular Name: azocan-1-yl-[2-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]-3-pyridyl]methanone azocan-1-yl-[2-[(2R)-2-(4-pyridy…
| 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) | 2.67 | 11.8 | -36.46 | 1 | 5 | 1 | 51 | 365.501 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 11.34 | -9.77 | 0 | 5 | 0 | 49 | 364.493 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.67 | 12.25 | -95.58 | 2 | 5 | 2 | 52 | 366.509 | 3 | ↓ |
