| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 14 | Yes |
Popular Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-triazole-4-carboxamide N-(5-methyl-1,3,4-thiadiazol-2-y…
| 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 | -0.03 | -13.11 | 2 | 7 | 0 | 96 | 210.222 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | -1.91 | -109.08 | 0 | 7 | -2 | 101 | 208.206 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.65 | -0.05 | -39.9 | 1 | 7 | -1 | 95 | 209.214 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
