| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 19 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone 2-(4-ethylpiperazin-1-yl)-1-(1,2…
| 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) | 1.11 | 7.37 | -34.5 | 1 | 4 | 1 | 30 | 264.393 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 5.09 | -7.79 | 0 | 4 | 0 | 28 | 263.385 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 7.29 | -33.74 | 1 | 4 | 1 | 30 | 264.393 | 4 | ↓ |
