In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 26 | Yes |
Popular Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,4,5-trimethyl-3-furyl)methanone [4-(1,3-benzodioxol-5-ylmethyl)p…
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) | 1.85 | 6.75 | -13.07 | 0 | 6 | 0 | 55 | 356.422 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.85 | 9.03 | -54.87 | 1 | 6 | 1 | 56 | 357.43 | 3 | ↓ |