| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2005 | 33 | No |
3-[1-[[(3'-NITRO[1,1'-BIPHENYL]-4-YL)OXY]METHYL]-3-(4-PYRIDINYL)PROPYL]-2,4-THIAZOLIDINEDIONE
| 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) | 4.35 | 1.34 | -16.68 | 0 | 8 | 0 | 105 | 463.515 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.35 | 1.45 | -44.54 | 1 | 8 | 1 | 106 | 464.523 | 9 | ↓ |
![3-[1-[(4-phenylphenoxy)methyl]-3-(4-pyridyl)propyl]thiazolidine-2,4-quinone](http://zinc12.docking.org/img/rings/245974.gif)
