| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 19 | Yes |
Popular Name: 1-(3,4-dimethylphenyl)-2-(4-ethylpiperazin-1-yl)ethanone 1-(3,4-dimethylphenyl)-2-(4-ethy…
| 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) | 2.58 | 7.84 | -35.84 | 1 | 3 | 1 | 25 | 261.389 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 5.55 | -7.27 | 0 | 3 | 0 | 24 | 260.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 7.75 | -38.54 | 1 | 3 | 1 | 25 | 261.389 | 4 | ↓ |
