| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2006 | 20 | No |
Popular Name: 4-[(6-bromobenzo[1,3]dioxol-5-yl)methyleneamino]-5-ethyl-1,2,4-triazole-3-thiol 4-[(6-bromobenzo[1,3]dioxol-5-yl…
| 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) | 2.17 | 7.46 | -18.45 | 1 | 6 | 0 | 64 | 355.217 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.90 | 7.91 | -49.11 | 0 | 6 | -1 | 62 | 354.209 | 3 | ↓ |
