| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: 1-[2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]-2-oxo-ethyl]cyclopentanecarboxylic 1-[2-[4-[(1S)-1-methylpropyl]pip…
| 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) | 1.76 | 9.76 | -75.46 | 1 | 5 | 0 | 65 | 296.411 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 7.94 | -58.78 | 0 | 5 | -1 | 64 | 295.403 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 7.31 | -47.79 | 2 | 5 | 1 | 62 | 297.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
