| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 23 | Yes |
Popular Name: 2-[(5-tert-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-isopropylphenyl)acetamide 2-[(5-tert-butyl-4H-1,2,4-triazo…
| 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) | 4.41 | 8.32 | -18.98 | 2 | 5 | 0 | 71 | 332.473 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.41 | 8.17 | -46.21 | 1 | 5 | -1 | 69 | 331.465 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
