In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2009 | 32 | Yes |
Popular Name: 3-[4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one 3-[4-[4-[(2,5-dimethoxyphenyl)me…
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) | 2.47 | 8.48 | -20.9 | 0 | 8 | 0 | 77 | 439.512 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 10.8 | -54.76 | 1 | 8 | 1 | 78 | 440.52 | 8 | ↓ |