| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 21 | No |
Popular Name: 4-isobutyl-5-[(1R)-1-(2-methoxyphenoxy)ethyl]-1,2,4-triazole-3-thiol 4-isobutyl-5-[(1R)-1-(2-methoxyp…
| 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) | 2.30 | 8.8 | -12.12 | 1 | 5 | 0 | 52 | 307.419 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 8.92 | -53.06 | 0 | 5 | -1 | 49 | 306.411 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
