| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2009 | 28 | No |
Popular Name: [3-nitro-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]phenyl]-phenyl-methanone [3-nitro-4-[4-(2,2,2-trifluoroet…
| 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) | 4.20 | 10.61 | -15.59 | 0 | 6 | 0 | 69 | 393.365 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 12.69 | -60.63 | 1 | 6 | 1 | 71 | 394.373 | 6 | ↓ |
