| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 9th, 2009 | 29 | Yes |
Popular Name: methyl-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]BLAHone methyl-[2-[4-(2-pyridyl)piperazi…
| 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) | 1.54 | 6.92 | -42.83 | 1 | 7 | 1 | 59 | 411.555 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 6.63 | -14.91 | 0 | 7 | 0 | 58 | 410.547 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 8.95 | -55.47 | 1 | 7 | 1 | 59 | 411.555 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.54 | 9.24 | -115.98 | 2 | 7 | 2 | 60 | 412.563 | 4 | ↓ |
