| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 22 | No |
Popular Name: 5-(4-chlorobenzyl)-4-(2-methoxyphenyl)-1,2,4-triazole-3-thiolate 5-(4-chlorobenzyl)-4-(2-methoxyp…
| 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) | 4.41 | 10.88 | -51.73 | 0 | 4 | -1 | 40 | 330.82 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 11.11 | -14.12 | 1 | 4 | 0 | 43 | 331.828 | 4 | ↓ |
