In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 36 | Yes |
Popular Name: 4-[[3-[4-[(E)-cinnamyl]piperazine-1-carbonyl]phenyl]methyl]-6-methyl-1,4-benzoxazin-3-one 4-[[3-[4-[(E)-cinnamyl]piperazin…
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) | 4.24 | 12.52 | -14.94 | 0 | 6 | 0 | 53 | 481.596 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.24 | 14.76 | -50.3 | 1 | 6 | 1 | 54 | 482.604 | 6 | ↓ |