In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 17 | Yes |
Popular Name: (3R,4S)-N,3-dimethyl-1-[[(1R,2S)-2-methylcyclohexyl]methyl]piperidin-4-amine (3R,4S)-N,3-dimethyl-1-[[(1R,2S)…
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) | 3.52 | 7.47 | -33.12 | 2 | 2 | 1 | 16 | 239.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 7.03 | -35.63 | 2 | 2 | 1 | 20 | 239.427 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 8.58 | -101.37 | 3 | 2 | 2 | 21 | 240.435 | 3 | ↓ |