| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 22 | Yes |
Popular Name: 1-[(4-ethylphenyl)methyl]-4-[(1S,3S)-3-methylcyclohexyl]piperazine 1-[(4-ethylphenyl)methyl]-4-[(1S…
| 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) | 4.46 | 10.74 | -33.72 | 1 | 2 | 1 | 8 | 301.498 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.46 | 8.5 | -1.83 | 0 | 2 | 0 | 6 | 300.49 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | 10.82 | -34.78 | 1 | 2 | 1 | 8 | 301.498 | 4 | ↓ |
