In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 16 | Yes |
Popular Name: 1-[(2S)-1-(cyclohexylmethyl)-2-piperidyl]-N-methyl-methanamine 1-[(2S)-1-(cyclohexylmethyl)-2-p…
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) | 3.31 | 8.77 | -112.2 | 3 | 2 | 2 | 21 | 226.408 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 7.24 | -35.98 | 2 | 2 | 1 | 20 | 225.4 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 7.48 | -30.17 | 2 | 2 | 1 | 16 | 225.4 | 4 | ↓ |