In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2011 | 23 | No |
Popular Name: (2Z,5E)-5-[(2-chloro-6-fluoro-phenyl)methylene]-2-(p-tolylimino)thiazolidin-4-one (2Z,5E)-5-[(2-chloro-6-fluoro-ph…
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) | 5.84 | 9.25 | -7.92 | 1 | 3 | 0 | 45 | 346.814 | 2 | ↓ |
Ref Reference (pH 7) | 5.84 | 9.67 | -8.01 | 1 | 3 | 0 | 45 | 346.814 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.29 | 8.19 | -45.43 | 0 | 3 | -1 | 48 | 345.806 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.29 | 7.5 | -46.89 | 0 | 3 | -1 | 48 | 345.806 | 2 | ↓ |