In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2008 | 25 | No |
Popular Name: (2E,5E)-5-[(3-ethoxy-4-hydroxy-5-iodo-phenyl)methylene]-2-phenylimino-thiazolidin-4-one (2E,5E)-5-[(3-ethoxy-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) | 5.60 | 7.7 | -10.63 | 2 | 5 | 0 | 75 | 466.3 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.05 | 7.11 | -102.12 | 0 | 5 | -2 | 81 | 464.284 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.05 | 6.19 | -42.13 | 1 | 5 | -1 | 78 | 465.292 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.60 | 8.61 | -46.81 | 1 | 5 | -1 | 78 | 465.292 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.05 | 6.43 | -103.95 | 0 | 5 | -2 | 81 | 464.284 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.60 | 8.2 | -46.85 | 1 | 5 | -1 | 78 | 465.292 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.05 | 5.5 | -43.74 | 1 | 5 | -1 | 78 | 465.292 | 4 | ↓ |