In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2007 | 18 | No |
Popular Name: 4-(4-aza-1-azoniabicyclo[2.2.2]oct-1-ylmethyl)benzamide 4-(4-aza-1-azoniabicyclo[2.2.2]o…
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) | -3.47 | -4.07 | -42.47 | 2 | 4 | 1 | 46 | 246.334 | 3 | ↓ |
Mid Mid (pH 6-8) | -3.47 | -0.73 | -119.37 | 3 | 4 | 2 | 48 | 247.342 | 3 | ↓ |