| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 19 | Yes |
Popular Name: 2-[[5-(1-methyl-1-phenyl-ethyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[5-(1-methyl-1-phenyl-ethyl)-…
| 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) | 2.05 | 7.73 | -41.7 | 1 | 5 | -1 | 82 | 276.341 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 7.53 | -103.3 | 0 | 5 | -2 | 80 | 275.333 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
