| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 18 | No |
Popular Name: 4-[(Z)-(4-bromo-2-fluoro-phenyl)methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione 4-[(Z)-(4-bromo-2-fluoro-phenyl)…
| 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) | 2.44 | 7.66 | -9.8 | 1 | 4 | 0 | 46 | 329.198 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 7.73 | -46.36 | 0 | 4 | -1 | 43 | 328.19 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
