In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2005 | 24 | No |
Popular Name: 2-hydroxybenzaldehyde [5-(4-methylbenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone 2-hydroxybenzaldehyde [5-(4-meth…
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) | 3.33 | 7.69 | -8.97 | 2 | 5 | 0 | 74 | 339.42 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 8.45 | -48.05 | 1 | 5 | -1 | 77 | 338.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 8.24 | -18.12 | 2 | 5 | 0 | 71 | 339.42 | 5 | ↓ |