In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 18 | Yes |
Popular Name: (1R,5S)-9-[2-[2-methoxyethyl(methyl)amino]ethyl]-9-azabicyclo[3.3.1]nonan-7-one (1R,5S)-9-[2-[2-methoxyethyl(met…
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) | 0.81 | 4.53 | -43.77 | 1 | 4 | 1 | 34 | 255.382 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 2.1 | -5.66 | 0 | 4 | 0 | 33 | 254.374 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.81 | 4.08 | -42.65 | 1 | 4 | 1 | 34 | 255.382 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.81 | 6.5 | -124.31 | 2 | 4 | 2 | 35 | 256.39 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.