| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-1H-triazole-4-carboxamide N-[5-(2-chlorophenyl)-1,3,4-thia…
| 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) | 2.18 | 3.58 | -14.98 | 2 | 7 | 0 | 96 | 306.738 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 1.72 | -114.17 | 0 | 7 | -2 | 101 | 304.722 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 3.56 | -42.05 | 1 | 7 | -1 | 95 | 305.73 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
