| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2009 | 22 | No |
Popular Name: (5E)-3-butyl-5-[(4-hydroxy-3-nitro-phenyl)methylene]-2-thioxo-thiazolidin-4-one (5E)-3-butyl-5-[(4-hydroxy-3-nit…
| 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) | 3.00 | 8.54 | -11.74 | 1 | 6 | 0 | 88 | 338.41 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 9.55 | -44.16 | 0 | 6 | -1 | 91 | 337.402 | 5 | ↓ |
