In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: 2-[1-[(1S)-2-amino-1-(4-fluorophenyl)ethyl]-4-piperidyl]acetamide 2-[1-[(1S)-2-amino-1-(4-fluoroph…
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) | 0.85 | 3.64 | -127.81 | 6 | 4 | 2 | 75 | 281.375 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 1.51 | -57.7 | 5 | 4 | 1 | 74 | 280.367 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 3.3 | -41.37 | 5 | 4 | 1 | 74 | 280.367 | 5 | ↓ |