| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 20 | Yes |
Popular Name: 1-[(1R,3S)-3-methylcyclohexyl]-4-(2-pyridylmethyl)piperazine 1-[(1R,3S)-3-methylcyclohexyl]-4…
| 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) | 2.37 | 7.5 | -37.1 | 1 | 3 | 1 | 21 | 274.432 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.37 | 5.24 | -4.11 | 0 | 3 | 0 | 19 | 273.424 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 7.55 | -32.59 | 1 | 3 | 1 | 21 | 274.432 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.37 | 7.89 | -85.91 | 2 | 3 | 2 | 22 | 275.44 | 3 | ↓ |
