In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 33 | Yes |
Popular Name: 3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazino]carbonyl}-6,7-dimethoxy-2H-chromen-2-one 3-{[4-(1,3-benzodioxol-5-ylmethy…
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) | 1.71 | 7.04 | -22.75 | 0 | 9 | 0 | 91 | 452.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 9.25 | -61.95 | 1 | 9 | 1 | 92 | 453.471 | 5 | ↓ |