In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 24 | Yes |
Popular Name: 1-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-4-piperazin-1-yl-butane-1,4-dione 1-(4-methyl-3-oxo-1,4-benzoxazin…
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) | -0.08 | 3.3 | -12.87 | 1 | 7 | 0 | 79 | 331.372 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.08 | 4.67 | -55.98 | 2 | 7 | 1 | 84 | 332.38 | 4 | ↓ |