In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-3-(dimethylamino)-1-(4-fluorophenyl)-1-phenyl-propane-1,2-diol (1S,2R)-3-(dimethylamino)-1-(4-f…
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) | 1.85 | 5.53 | -37.71 | 3 | 3 | 1 | 45 | 290.358 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 3.1 | -5.93 | 2 | 3 | 0 | 44 | 289.35 | 5 | ↓ |