| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 26 | No |
Popular Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(3,4-dihydroxyphenyl)ethanone 2-[[4-allyl-5-(3-pyridyl)-1,2,4-…
| 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) | 2.25 | 5.58 | -15.54 | 2 | 7 | 0 | 101 | 368.418 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 6.5 | -48.7 | 1 | 7 | -1 | 104 | 367.41 | 7 | ↓ |
