In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 31 | Yes |
Popular Name: 4-[4-[4-[(E)-cinnamyl]piperazin-1-yl]-4-oxo-butyl]-1,4-benzothiazin-3-one 4-[4-[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) | 3.74 | 11.51 | -14.99 | 0 | 5 | 0 | 44 | 435.593 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 13.82 | -56.75 | 1 | 5 | 1 | 45 | 436.601 | 7 | ↓ |