| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 24 | No |
Popular Name: 6-[(3S,5R)-2-(2,5-difluorophenyl)-5-isobutyl-1,2,4-triazolidin-3-yl]-1H-pyridin-2-one 6-[(3S,5R)-2-(2,5-difluorophenyl…
| 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) | 3.39 | 6.1 | -57.4 | 4 | 5 | 1 | 65 | 335.378 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | 4.52 | -8.14 | 3 | 5 | 0 | 60 | 334.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
