In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 16 | Yes |
Popular Name: (1R,5S)-7-hexyl-3-methyl-3,7-diazabicyclo[3.3.1]nonane (1R,5S)-7-hexyl-3-methyl-3,7-dia…
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) | 3.56 | 10.09 | -25.6 | 1 | 2 | 1 | 8 | 225.4 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 10.18 | -25.75 | 1 | 2 | 1 | 8 | 225.4 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 10.58 | -99.06 | 2 | 2 | 2 | 9 | 226.408 | 5 | ↓ |