| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 17 | Yes |
Popular Name: 4-[[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]amino]butanoic 4-[[2-(4-methylpiperazin-1-yl)-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) | -1.22 | 2.86 | -64.1 | 2 | 6 | 0 | 80 | 243.307 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.22 | 1.52 | -51.31 | 1 | 6 | -1 | 76 | 242.299 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.22 | 5.21 | -111.53 | 3 | 6 | 1 | 81 | 244.315 | 6 | ↓ |
