| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 16 | Yes |
Popular Name: (1S,2R,4S)-4-ethyl-2-(4-methylpiperazin-1-yl)cyclohexanamine (1S,2R,4S)-4-ethyl-2-(4-methylpi…
| 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) | 1.19 | 4.71 | -98.94 | 4 | 3 | 2 | 35 | 227.396 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 2.33 | -41.91 | 3 | 3 | 1 | 34 | 226.388 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | 3.99 | -117.62 | 4 | 3 | 2 | 35 | 227.396 | 2 | ↓ |
