| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 16 | No |
Popular Name: 5-ethyl-4-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1,2,4-triazole-3-thiol 5-ethyl-4-[(1S)-2-imidazol-1-yl-…
| 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) | 0.15 | 8.58 | -12.89 | 1 | 5 | 0 | 51 | 237.332 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 7.93 | -41.3 | 0 | 5 | -1 | 49 | 236.324 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.15 | 9.1 | -45.48 | 2 | 5 | 1 | 53 | 238.34 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
