| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 20 | Yes |
Popular Name: (4-methylpiperazin-1-yl)-(2-pyrrolidin-1-yl-3-pyridyl)methanone (4-methylpiperazin-1-yl)-(2-pyrr…
| 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) | 0.35 | 5.49 | -8.92 | 0 | 5 | 0 | 40 | 274.368 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.35 | 7.85 | -46.4 | 1 | 5 | 1 | 41 | 275.376 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.35 | 8.37 | -88.4 | 2 | 5 | 2 | 42 | 276.384 | 2 | ↓ |
