| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 16 | No |
Popular Name: 4-(4-dimethylaminophenyl)-5-methyl-1,2,4-triazole-3-thiol 4-(4-dimethylaminophenyl)-5-meth…
| 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) | 0.91 | 7.73 | -12.12 | 1 | 4 | 0 | 37 | 234.328 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 7.86 | -49.48 | 0 | 4 | -1 | 34 | 233.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
