In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 24 | No |
Popular Name: (2Z,5E)-5-[(2-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-2-phenylimino-thiazolidin-4-one (2Z,5E)-5-[(2-bromo-4-hydroxy-5-…
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) | 4.72 | 5.79 | -8.6 | 2 | 5 | 0 | 75 | 405.273 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 6.66 | -96.66 | 0 | 5 | -2 | 76 | 403.257 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.17 | 4.67 | -42.01 | 1 | 5 | -1 | 78 | 404.265 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.72 | 7.12 | -47.46 | 1 | 5 | -1 | 78 | 404.265 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.17 | 4 | -43.79 | 1 | 5 | -1 | 78 | 404.265 | 3 | ↓ |