| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | No |
Popular Name: (2E,4Z)-N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]hexa-2,4-dienamide (2E,4Z)-N-[5-(2-chlorophenyl)-1,…
| 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) | 3.80 | 8.18 | -17.24 | 1 | 4 | 0 | 55 | 305.79 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 6.33 | -52.46 | 0 | 4 | -1 | 61 | 304.782 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
