| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: (1S,2S,4R)-N1-ethyl-N2-[(4-fluorophenyl)methyl]-N2,4-dimethyl-cyclohexane-1,2-diamine (1S,2S,4R)-N1-ethyl-N2-[(4-fluor…
| 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) | 3.46 | 9.67 | -121.52 | 3 | 2 | 2 | 21 | 280.431 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 7.77 | -37.13 | 2 | 2 | 1 | 20 | 279.423 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 8.62 | -36.4 | 2 | 2 | 1 | 16 | 279.423 | 5 | ↓ |
