| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 15 | No |
Popular Name: 4-Allyl-5-(4-methyl-[1,2,3]thiadiazol-5-yl)-4H-[1,2,4]triazole-3-thiol 4-Allyl-5-(4-methyl-[1,2,3]thiad…
| 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) | 1.87 | 5.68 | -36.4 | 0 | 5 | -1 | 57 | 238.321 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 5.55 | -8.64 | 1 | 5 | 0 | 59 | 239.329 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
