| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 21 | Yes |
Popular Name: 3-(2-amino-4-fluoro-phenyl)-6-phenyl-2H-1,2,4-triazin-5-one 3-(2-amino-4-fluoro-phenyl)-6-ph…
| 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) | 2.96 | 2.92 | -43.37 | 2 | 5 | -1 | 88 | 281.27 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.51 | 5.28 | -12.25 | 3 | 5 | 0 | 85 | 282.278 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
