In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 1-[2-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]ethanone 1-[2-[2-(4-ethylpiperazin-1-yl)e…
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) | 2.14 | 7.97 | -35.84 | 1 | 4 | 1 | 34 | 277.388 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 5.77 | -10.63 | 0 | 4 | 0 | 33 | 276.38 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 7.91 | -33.64 | 1 | 4 | 1 | 34 | 277.388 | 6 | ↓ |