In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 26 | Yes |
Popular Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-methoxy-phenol 4-[[4-(1,3-benzodioxol-5-ylmethy…
None
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) | 2.26 | 5.19 | -50.26 | 2 | 6 | 1 | 56 | 357.43 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 5.13 | -49.97 | 2 | 6 | 1 | 56 | 357.43 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 2.81 | -12.49 | 1 | 6 | 0 | 54 | 356.422 | 5 | ↓ |