In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2004 | 24 | No |
Popular Name: (2E,5Z)-5-(5-bromo-3-chloro-2-hydroxy-benzylidene)-2-(2-chlorophenyl)imino-thiazolidin-4-one (2E,5Z)-5-(5-bromo-3-chloro-2-hy…
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) | 6.39 | 6.78 | -8.9 | 2 | 4 | 0 | 65 | 444.137 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.85 | 5.52 | -97.9 | 0 | 4 | -2 | 71 | 442.121 | 2 | ↓ |
Hi High (pH 8-9.5) | 6.85 | 5.83 | -95.51 | 0 | 4 | -2 | 71 | 442.121 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.91 | 7.33 | -89.57 | 0 | 4 | -2 | 67 | 442.121 | 3 | ↓ |
Mid Mid (pH 6-8) | 6.39 | 7.55 | -34.2 | 1 | 4 | -1 | 68 | 443.129 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.91 | 7.13 | -39.67 | 1 | 4 | -1 | 64 | 443.129 | 3 | ↓ |
Mid Mid (pH 6-8) | 6.39 | 7.85 | -33.79 | 1 | 4 | -1 | 68 | 443.129 | 2 | ↓ |