In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-1-(2-bromo-4-fluoro-phenoxy)-1-phenyl-propan-2-amine (1S,2R)-1-(2-bromo-4-fluoro-phen…
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) | 3.68 | 6.98 | -50.27 | 3 | 2 | 1 | 37 | 325.201 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.68 | 6.66 | -3.6 | 2 | 2 | 0 | 35 | 324.193 | 4 | ↓ |