In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 17 | Yes |
Popular Name: (2R)-2-[(2S)-2-ethyl-1-piperidyl]-2-(4-pyridyl)ethanamine (2R)-2-[(2S)-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) | 1.21 | 3.85 | -50.49 | 3 | 3 | 1 | 44 | 234.367 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 3.83 | -3.19 | 2 | 3 | 0 | 42 | 233.359 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 5.56 | -31.72 | 3 | 3 | 1 | 43 | 234.367 | 4 | ↓ |