In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 38 | Yes |
Popular Name: 4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-6-(1,1-dimethylpropyl)-1,4-benzoxazin-3-one 4-[2-(4-benzhydrylpiperazin-1-yl…
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) | 5.66 | 14.31 | -14.36 | 0 | 6 | 0 | 53 | 511.666 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.66 | 16.04 | -52.62 | 1 | 6 | 1 | 54 | 512.674 | 7 | ↓ |