In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 18 | Yes |
Popular Name: 6-[(3,4-difluorophenyl)methylamino]-2H-1,2,4-triazine-3,5-dione 6-[(3,4-difluorophenyl)methylami…
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) | 0.42 | 1.17 | -9.74 | 3 | 6 | 0 | 91 | 254.196 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.88 | -0.49 | -35.98 | 2 | 6 | -1 | 94 | 253.188 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.