In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | Yes |
Popular Name: [(1R,2S)-1-[(2S)-2-ethyl-1-piperidyl]-2-methyl-cyclohexyl]methanamine [(1R,2S)-1-[(2S)-2-ethyl-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) | 3.14 | 6.64 | -114.63 | 4 | 2 | 2 | 32 | 240.435 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.14 | 4.56 | -42.4 | 3 | 2 | 1 | 31 | 239.427 | 3 | ↓ |