In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 17 | Yes |
Popular Name: N'-[(1R,5S)-8-azabicyclo[3.2.1]octan-3-yl]-N,N-diethyl-N'-methyl-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) | 1.68 | 5.02 | -80.66 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.68 | 2.88 | -35.05 | 2 | 3 | 1 | 23 | 240.415 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.68 | 7.51 | -189.27 | 4 | 3 | 3 | 25 | 242.431 | 6 | ↓ |