| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 21 | No |
Popular Name: 4-[(3,4-difluorophenyl)methyl]-5-phenyl-1,2,4-triazole-3-thiol 4-[(3,4-difluorophenyl)methyl]-5…
| 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) | 4.14 | 10.59 | -42.72 | 0 | 3 | -1 | 31 | 302.329 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 10.58 | -13.41 | 1 | 3 | 0 | 34 | 303.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
