In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 31 | Yes |
Popular Name: N-[(1R,2R)-1-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-2-methyl-butyl]heptanamide N-[(1R,2R)-1-[4-[(E)-cinnamyl]pi…
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) | 5.58 | 11.41 | -8.22 | 1 | 5 | 0 | 53 | 427.633 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.58 | 13.63 | -48.17 | 2 | 5 | 1 | 54 | 428.641 | 12 | ↓ |