In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | Yes |
Popular Name: (2S)-2-amino-1-[(3S)-3-methyl-1-piperidyl]-2-phenyl-ethanone (2S)-2-amino-1-[(3S)-3-methyl-1-…
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) | -0.07 | 5.12 | -44.55 | 3 | 3 | 1 | 48 | 233.335 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 4.79 | -9.79 | 2 | 3 | 0 | 46 | 232.327 | 2 | ↓ |