In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 24 | Yes |
Popular Name: 2-[2-[[(5S)-1-azabicyclo[3.2.1]octan-5-yl]oxy]phenyl]-1,3-benzothiazole 2-[2-[[(5S)-1-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) | 4.92 | 10.14 | -42.87 | 1 | 3 | 1 | 27 | 337.468 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.92 | 7.46 | -10.6 | 0 | 3 | 0 | 25 | 336.46 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.