In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Popular Name: (1S)-1-[4-(3,5-dimethylphenoxy)-3-fluoro-phenyl]-N-methyl-ethanamine (1S)-1-[4-(3,5-dimethylphenoxy)-…
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) | 4.73 | 9.28 | -44.25 | 2 | 2 | 1 | 26 | 274.359 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.73 | 8.1 | -5.47 | 1 | 2 | 0 | 21 | 273.351 | 4 | ↓ |