In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(2-methoxy-4-methyl-phenyl)ethanone 2-(4-ethylpiperazin-1-yl)-1-(2-m…
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) | 2.19 | 7.77 | -37.43 | 1 | 4 | 1 | 34 | 277.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 5.48 | -9.86 | 0 | 4 | 0 | 33 | 276.38 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 7.67 | -39.31 | 1 | 4 | 1 | 34 | 277.388 | 5 | ↓ |