In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 19 | Yes |
Popular Name: 1-[2-[(1S)-1-aminoethyl]-3-fluoro-phenyl]piperidine-4-carboxamide 1-[2-[(1S)-1-aminoethyl]-3-fluor…
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) | -0.52 | 2.02 | -43.58 | 5 | 4 | 1 | 74 | 266.34 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.52 | 1.7 | -11.18 | 4 | 4 | 0 | 72 | 265.332 | 3 | ↓ |