In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 27 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2,3-dimethoxyphenyl)methyl]piperazine 1-(1,3-benzodioxol-5-ylmethyl)-4…
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) | 2.74 | 7.47 | -43.54 | 1 | 6 | 1 | 45 | 371.457 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 7.41 | -43.42 | 1 | 6 | 1 | 45 | 371.457 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.08 | -9.73 | 0 | 6 | 0 | 43 | 370.449 | 6 | ↓ |