| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 21st, 2009 | 31 | No |
Popular Name: 4-[[4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]benzonitrile 4-[[4-[2,6-dinitro-4-(trifluorom…
| 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) | 3.75 | 10.51 | -8.91 | 0 | 9 | 0 | 122 | 435.362 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 12.82 | -54.43 | 1 | 9 | 1 | 123 | 436.37 | 6 | ↓ |
