In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 21 | Yes |
Popular Name: (1S)-1-[3-fluoro-4-(3-isopropylphenoxy)phenyl]-N-methyl-ethanamine (1S)-1-[3-fluoro-4-(3-isopropylp…
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) | 5.39 | 9.92 | -45.27 | 2 | 2 | 1 | 26 | 288.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.39 | 8.74 | -4.75 | 1 | 2 | 0 | 21 | 287.378 | 5 | ↓ |