In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 22 | No |
Popular Name: (2E,5E)-5-[(4-bromophenyl)methylene]-2-(2-chlorophenyl)imino-thiazolidin-4-one (2E,5E)-5-[(4-bromophenyl)methyl…
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) | 6.08 | 9.61 | -8.81 | 1 | 3 | 0 | 45 | 393.693 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.54 | 7.59 | -43.47 | 0 | 3 | -1 | 48 | 392.685 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.54 | 8.05 | -40.46 | 0 | 3 | -1 | 48 | 392.685 | 2 | ↓ |