In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 28th, 2008 | 23 | No |
Popular Name: 4-[(E)-[(2Z)-2-(2-chlorophenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]benzonitrile 4-[(E)-[(2Z)-2-(2-chlorophenyl)i…
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) | 5.03 | 9.11 | -11.96 | 1 | 4 | 0 | 69 | 339.807 | 2 | ↓ |
Ref Reference (pH 7) | 4.54 | 8.99 | -38.01 | 0 | 4 | -1 | 68 | 338.799 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.48 | 7.37 | -43.75 | 0 | 4 | -1 | 72 | 338.799 | 2 | ↓ |