| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 16 | Yes |
Popular Name: (1S,2R,4R)-4-methyl-2-(4-methylpiperazin-1-yl)cyclohexanecarbonitrile (1S,2R,4R)-4-methyl-2-(4-methylp…
| 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) | 1.80 | 6.14 | -40.66 | 1 | 3 | 1 | 31 | 222.356 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 5.72 | -40.69 | 1 | 3 | 1 | 31 | 222.356 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 3.79 | -7.38 | 0 | 3 | 0 | 30 | 221.348 | 1 | ↓ |
