| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 20 | No |
Popular Name: 4-[3-(methoxymethyl)phenyl]-5-(2-thienyl)-1,2,4-triazole-3-thiol 4-[3-(methoxymethyl)phenyl]-5-(2…
| 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) | 3.49 | 9.05 | -54.52 | 0 | 4 | -1 | 40 | 302.404 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.76 | 8.97 | -13.11 | 1 | 4 | 0 | 43 | 303.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
