| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 25 | No |
Popular Name: 3-[(6S)-5-oxo-3-thioxo-6H-1,2,4-triazin-6-yl]-N-[4-(2,2,2-trifluoroethoxy)phenyl]propanamide 3-[(6S)-5-oxo-3-thioxo-6H-1,2,4-…
| 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) | 1.87 | 3.05 | -17.55 | 2 | 7 | 0 | 92 | 374.344 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 1.13 | -46.5 | 1 | 7 | -1 | 98 | 373.336 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
