In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[(2R)-2-ethyl-1-piperidyl]-2-methyl-4-phenyl-butan-1-amine (2S)-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) | 3.68 | 7.15 | -46.9 | 3 | 2 | 1 | 31 | 275.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 8.46 | -29.1 | 3 | 2 | 1 | 30 | 275.46 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 8.8 | -122.85 | 4 | 2 | 2 | 32 | 276.468 | 6 | ↓ |