| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 13 | No |
Popular Name: 4-[(4-methylthiazol-2-yl)methyl]-1,2,4-triazole-3-thiol 4-[(4-methylthiazol-2-yl)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) | 0.65 | 5.94 | -42.25 | 0 | 4 | -1 | 44 | 211.295 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.07 | 5.84 | -12.09 | 1 | 4 | 0 | 47 | 212.303 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
