In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 19 | Yes |
Popular Name: (2S)-2-(4-ethyl-4-methyl-1-piperidyl)-2-(4-fluorophenyl)ethanamine (2S)-2-(4-ethyl-4-methyl-1-piper…
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) | 2.79 | 7.65 | -128.36 | 4 | 2 | 2 | 32 | 266.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 7.96 | -33.9 | 3 | 2 | 1 | 30 | 265.396 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 5.76 | -47.49 | 3 | 2 | 1 | 31 | 265.396 | 4 | ↓ |