| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2011 | 17 | Yes |
Popular Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-2-carbonitrile 4-[4-(2-hydroxyethyl)piperazin-1…
| 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) | 0.22 | 0.39 | -8.75 | 1 | 5 | 0 | 63 | 232.287 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 2.68 | -45.82 | 2 | 5 | 1 | 65 | 233.295 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
