| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 35 | Yes |
Popular Name: [5-[(4-ethylphenoxy)methyl]-4-isobutyl-1,2,4-triazol-3-yl]sulfanylmethylBLAHone [5-[(4-ethylphenoxy)methyl]-4-is…
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) | 5.80 | 10.76 | -59.77 | 0 | 8 | -1 | 102 | 488.593 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 12.66 | -25.59 | 1 | 8 | 0 | 99 | 489.601 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 13.15 | -19.79 | 1 | 8 | 0 | 99 | 489.601 | 9 | ↓ |
