In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 7th, 2011 | 17 | No |
Popular Name: (5E)-5-[(Z)-3-(4-bromophenyl)prop-2-enylidene]-2-thioxo-thiazolidin-4-one (5E)-5-[(Z)-3-(4-bromophenyl)pro…
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) | 3.85 | 5.38 | -42.6 | 0 | 2 | -1 | 36 | 325.232 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 7.3 | -8.07 | 1 | 2 | 0 | 33 | 326.24 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.