| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 18 | No |
Popular Name: (5E)-5-[(4-prop-2-ynoxyphenyl)methylene]-2-thioxo-thiazolidin-4-one (5E)-5-[(4-prop-2-ynoxyphenyl)me…
| 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) | 2.50 | 4.44 | -44.73 | 0 | 3 | -1 | 45 | 274.346 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.04 | 6.27 | -12.12 | 1 | 3 | 0 | 42 | 275.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
