| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2008 | 21 | Yes |
Popular Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine 2-[[5-(4-fluorophenyl)-4-methyl-…
| 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) | 3.08 | 9.35 | -12.11 | 0 | 4 | 0 | 44 | 300.362 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 9.62 | -39.5 | 1 | 4 | 1 | 45 | 301.37 | 4 | ↓ |
