| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 30 | No |
Popular Name: [4-[4-(2-hydroxyethyl)piperazin-1-yl]-3-nitro-phenyl]BLAHdione [4-[4-(2-hydroxyethyl)piperazin-…
| 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) | 1.79 | 6.53 | -16.98 | 1 | 9 | 0 | 110 | 412.446 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 8.84 | -49.91 | 2 | 9 | 1 | 111 | 413.454 | 5 | ↓ |
