In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 21 | No |
Popular Name: N-[(5Z)-5-[(3-hydroxy-4-methoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetamide N-[(5Z)-5-[(3-hydroxy-4-methoxy-…
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) | 0.35 | 3.29 | -17.88 | 2 | 6 | 0 | 81 | 324.383 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 1.49 | -55.09 | 1 | 6 | -1 | 87 | 323.375 | 3 | ↓ |