| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | Yes |
Popular Name: [(1R,2S)-2-(4-tert-butylpiperazin-1-yl)cyclohexyl]methanamine [(1R,2S)-2-(4-tert-butylpiperazi…
| 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) | 1.99 | 5.04 | -91.92 | 4 | 3 | 2 | 35 | 255.45 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 2.91 | -43.2 | 3 | 3 | 1 | 34 | 254.442 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 4.6 | -111.92 | 4 | 3 | 2 | 35 | 255.45 | 3 | ↓ |
