In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-2-(4-ethyl-1-piperidyl)-2,3-dimethyl-butan-1-amine (2S)-2-(4-ethyl-1-piperidyl)-2,3…
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) | 2.54 | 6.03 | -112.05 | 4 | 2 | 2 | 32 | 214.397 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 5.21 | -37.84 | 3 | 2 | 1 | 31 | 213.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 5.89 | -25.21 | 3 | 2 | 1 | 30 | 213.389 | 4 | ↓ |