| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 26 | No |
Popular Name: 4-methylsulfanyl-2-[4-oxo-5-(4-quinolylmethylene)-2-thioxo-thiazolidin-3-yl]-butanoic 4-methylsulfanyl-2-[4-oxo-5-(4-q…
| 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) | 2.16 | -1.57 | -54.89 | 0 | 5 | -1 | 75 | 403.53 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | -1.49 | -75.99 | 1 | 5 | 0 | 76 | 404.538 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
