In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 25 | No |
Popular Name: 5-[(4-hydroxy-3-iodo-5-methoxy-phenyl)methylene]-2-(m-tolylimino)thiazolidin-4-one 5-[(4-hydroxy-3-iodo-5-methoxy-p…
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) | 5.64 | 7.02 | -10.65 | 2 | 5 | 0 | 75 | 466.3 | 3 | ↓ |
Hi High (pH 8-9.5) | 6.10 | 6.18 | -103.82 | 0 | 5 | -2 | 81 | 464.284 | 3 | ↓ |
Hi High (pH 8-9.5) | 6.10 | 5.26 | -44.4 | 1 | 5 | -1 | 78 | 465.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 6.10 | 5.95 | -42.95 | 1 | 5 | -1 | 78 | 465.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.64 | 7.94 | -46.51 | 1 | 5 | -1 | 78 | 465.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.64 | 8.36 | -46.49 | 1 | 5 | -1 | 78 | 465.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.16 | 7.93 | -98.35 | 0 | 5 | -2 | 76 | 464.284 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.10 | 6.88 | -102.22 | 0 | 5 | -2 | 81 | 464.284 | 3 | ↓ |