In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 15 | Yes |
Popular Name: N'-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-N,N,N'-trimethyl-ethane-1,2-diamine N'-[(1R,5S)-8-azabicyclo[3.2.1]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) | 0.92 | 3.65 | -81.56 | 3 | 3 | 2 | 24 | 213.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 1.18 | -35.57 | 2 | 3 | 1 | 23 | 212.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.92 | 6.14 | -187.3 | 4 | 3 | 3 | 25 | 214.377 | 4 | ↓ |