In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 23 | Yes |
Popular Name: 5-[[(5R)-1-azabicyclo[3.2.1]octan-5-yl]oxy]-4-ethyl-7-methyl-chromen-2-one 5-[[(5R)-1-azabicyclo[3.2.1]octa…
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) | 3.89 | 10.43 | -53.3 | 1 | 4 | 1 | 44 | 314.405 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 7.74 | -9.09 | 0 | 4 | 0 | 43 | 313.397 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.