| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 16 | No |
Popular Name: 4-[(Z)-(4-bromo-2-thienyl)methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione 4-[(Z)-(4-bromo-2-thienyl)methyl…
| 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) | 2.90 | 7.06 | -47.69 | 0 | 4 | -1 | 43 | 316.229 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 7.08 | -12.08 | 1 | 4 | 0 | 46 | 317.237 | 3 | ↓ |
