In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 23 | Yes |
Popular Name: (1S)-N-benzyl-1-[3-fluoro-4-(1-piperidyl)phenyl]ethanamine (1S)-N-benzyl-1-[3-fluoro-4-(1-p…
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) | 4.56 | 11.77 | -45.11 | 2 | 2 | 1 | 20 | 313.44 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.56 | 10.65 | -3.13 | 1 | 2 | 0 | 15 | 312.432 | 5 | ↓ |