In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 13 | No |
Popular Name: 4-Methyl-5-(4-methyl-[1,2,3]thiadiazol-5-yl)-4H-[1,2,4]triazole-3-thiol 4-Methyl-5-(4-methyl-[1,2,3]thia…
None
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) | 1.23 | 4.24 | -36.94 | 0 | 5 | -1 | 57 | 212.283 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.50 | 4.11 | -9.9 | 1 | 5 | 0 | 59 | 213.291 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.