In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 23 | Yes |
Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-methylpiperazin-1-yl)butane-1,4-dione 1-(2,3-dihydro-1,4-benzodioxin-6…
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) | 0.75 | 4.73 | -10.84 | 0 | 6 | 0 | 59 | 318.373 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.75 | 7.09 | -46.55 | 1 | 6 | 1 | 60 | 319.381 | 4 | ↓ |