| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: 1-[2-oxo-2-(4-prop-2-ynylpiperazin-1-yl)ethyl]cyclohexanecarboxylic 1-[2-oxo-2-(4-prop-2-ynylpiperaz…
| 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) | 1.22 | 7.43 | -60.56 | 0 | 5 | -1 | 64 | 291.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 5.43 | -15.47 | 1 | 5 | 0 | 61 | 292.379 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 7.67 | -52.01 | 2 | 5 | 1 | 62 | 293.387 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 9.67 | -76.48 | 1 | 5 | 0 | 65 | 292.379 | 4 | ↓ |
