| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 23 | Yes |
Popular Name: 2-[[5-[(2-tert-butyl-5-methyl-phenoxy)methyl]-4H-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[5-[(2-tert-butyl-5-methyl-ph…
| 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) | 3.40 | 9.27 | -42.7 | 1 | 6 | -1 | 91 | 334.421 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 8.39 | -103.94 | 0 | 6 | -2 | 89 | 333.413 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 9.34 | -44.86 | 1 | 6 | -1 | 91 | 334.421 | 7 | ↓ |
