In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 20 | Yes |
Popular Name: 1-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone 1-[4-[3-(4-methylpiperazin-1-yl)…
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) | 2.09 | 6.79 | -42 | 1 | 4 | 1 | 34 | 277.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 6.65 | -45.74 | 1 | 4 | 1 | 34 | 277.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 4.33 | -8.79 | 0 | 4 | 0 | 33 | 276.38 | 6 | ↓ |