In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 27 | Yes |
Popular Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]acetamide N-(1,3-benzodioxol-5-yl)-2-[4-[(…
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) | 2.81 | 6.73 | -41.94 | 2 | 6 | 1 | 55 | 372.42 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 4.13 | -19.59 | 1 | 6 | 0 | 54 | 371.412 | 5 | ↓ |