In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2011 | 21 | Yes |
Popular Name: 5,6-difluoro-3-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl]quinoline 5,6-difluoro-3-[(1S,5R)-8-methyl…
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) | 3.23 | 9.4 | -39.5 | 1 | 2 | 1 | 17 | 287.333 | 1 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 7.04 | -4.53 | 0 | 2 | 0 | 16 | 286.325 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.