| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-(2-pyrrolidin-1-yl-3-pyridyl)methanone (4-ethylpiperazin-1-yl)-(2-pyrro…
| 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) | 0.73 | 6.28 | -8.72 | 0 | 5 | 0 | 40 | 288.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 8.51 | -44.94 | 1 | 5 | 1 | 41 | 289.403 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.73 | 9.03 | -87.97 | 2 | 5 | 2 | 42 | 290.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
