In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 33 | Yes |
Popular Name: 1,3-benzodioxol-5-yl-[4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone 1,3-benzodioxol-5-yl-[4-[5-ethyl…
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) | 4.40 | 12.56 | -38.27 | 1 | 7 | 1 | 69 | 445.543 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.40 | 12.23 | -13.79 | 0 | 7 | 0 | 68 | 444.535 | 4 | ↓ |