In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 26 | No |
Popular Name: (5E)-1-(1,3-benzodioxol-5-yl)-5-[(4-fluorophenyl)methylene]hexahydropyrimidine-2,4,6-trione (5E)-1-(1,3-benzodioxol-5-yl)-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) | 2.36 | 3.17 | -45.02 | 0 | 7 | -1 | 93 | 353.285 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 5.72 | -11.85 | 1 | 7 | 0 | 90 | 354.293 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.