In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 25 | No |
Popular Name: 2-hydroxy-5-[(5E)-5-[(3-hydroxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic 2-hydroxy-5-[(5E)-5-[(3-hydroxyp…
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) | 2.78 | 5.52 | -59.09 | 2 | 6 | -1 | 103 | 372.403 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 6.3 | -118.42 | 1 | 6 | -2 | 105 | 371.395 | 3 | ↓ |