In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | No |
Popular Name: (3R)-3-[[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-methyl-amino]pyrrolidine-2,5-dione (3R)-3-[[(1R,5S)-8-azabicyclo[3.…
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) | -0.56 | 1.66 | -44.46 | 3 | 5 | 1 | 66 | 238.311 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.37 | -0.95 | -63.46 | 2 | 5 | 0 | 72 | 237.303 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.37 | -1.15 | -85.11 | 3 | 5 | 1 | 74 | 238.311 | 2 | ↓ |