In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 24 | Yes |
Popular Name: 4-[4-(4-ethylpiperazin-1-yl)-4-oxo-butyl]-1,4-benzoxazin-3-one 4-[4-(4-ethylpiperazin-1-yl)-4-o…
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) | 1.39 | 5.83 | -15.81 | 0 | 6 | 0 | 53 | 331.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 8.09 | -52.26 | 1 | 6 | 1 | 54 | 332.424 | 5 | ↓ |