In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (2R)-2-[(2R)-2-ethyl-1-piperidyl]-2-[(3S)-tetrahydrofuran-3-yl]ethanamine (2R)-2-[(2R)-2-ethyl-1-piperidyl…
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) | 1.39 | 2.13 | -45.81 | 3 | 3 | 1 | 40 | 227.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 2.45 | -1.76 | 2 | 3 | 0 | 38 | 226.364 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 3.86 | -124.87 | 4 | 3 | 2 | 41 | 228.38 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 3.43 | -28.33 | 3 | 3 | 1 | 40 | 227.372 | 4 | ↓ |