In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: 1-[(1R,2S)-2-ethylcyclohexyl]-N-methyl-piperidin-4-amine 1-[(1R,2S)-2-ethylcyclohexyl]-N-…
None
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) | 3.17 | 6.5 | -31.32 | 2 | 2 | 1 | 16 | 225.4 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 5.98 | -36.05 | 2 | 2 | 1 | 20 | 225.4 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.75 | -101.28 | 3 | 2 | 2 | 21 | 226.408 | 3 | ↓ |