In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 34 | Yes |
Popular Name: N-[(1S)-1-benzyl-2-[4-[(E)-cinnamyl]piperazin-1-yl]-2-oxo-ethyl]heptanamide N-[(1S)-1-benzyl-2-[4-[(E)-cinna…
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) | 5.76 | 12.67 | -9.34 | 1 | 5 | 0 | 53 | 461.65 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.76 | 14.92 | -53.05 | 2 | 5 | 1 | 54 | 462.658 | 12 | ↓ |