| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 20 | No |
Popular Name: (5E)-3-(2-aminoethyl)-5-[(4-nitrophenyl)methylene]-2-thioxo-thiazolidin-4-one (5E)-3-(2-aminoethyl)-5-[(4-nitr…
| 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) | 0.66 | 6.23 | -52.93 | 3 | 6 | 1 | 95 | 310.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 5.86 | -13.88 | 2 | 6 | 0 | 94 | 309.372 | 4 | ↓ |
