| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 26 | Yes |
Popular Name: (2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one (2S)-2-[4-(2,3-dimethylphenyl)pi…
| 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) | 2.68 | 9.71 | -44.74 | 1 | 5 | 1 | 31 | 359.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 7.52 | -34.25 | 1 | 5 | 1 | 31 | 359.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 7.49 | -8.34 | 0 | 5 | 0 | 30 | 358.53 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 9.76 | -85.74 | 2 | 5 | 2 | 32 | 360.546 | 4 | ↓ |
