| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 7th, 2011 | 19 | No |
Popular Name: (5E)-5-[(Z)-3-(4-dimethylaminophenyl)prop-2-enylidene]-2-thioxo-thiazolidin-4-one (5E)-5-[(Z)-3-(4-dimethylaminoph…
| 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) | 3.14 | 5.14 | -46.83 | 0 | 3 | -1 | 39 | 289.405 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 5.92 | -71.75 | 1 | 3 | 0 | 40 | 290.413 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.68 | 7.1 | -8.46 | 1 | 3 | 0 | 36 | 290.413 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
