| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 19 | No |
Popular Name: (5E)-5-[(4-but-3-ynoxyphenyl)methylene]-2-thioxo-thiazolidin-4-one (5E)-5-[(4-but-3-ynoxyphenyl)met…
| 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) | 2.77 | 5.21 | -42.67 | 0 | 3 | -1 | 45 | 288.373 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | 7.05 | -10.35 | 1 | 3 | 0 | 42 | 289.381 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
