In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 29 | Yes |
Popular Name: 4-[4-[(E)-cinnamyl]piperazin-1-yl]-6-(4-methoxyphenyl)pyrimidine 4-[4-[(E)-cinnamyl]piperazin-1-y…
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) | 4.43 | 13.97 | -48.78 | 1 | 5 | 1 | 43 | 387.507 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 14.32 | -97.91 | 2 | 5 | 2 | 44 | 388.515 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 11.71 | -8.72 | 0 | 5 | 0 | 41 | 386.499 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 12.07 | -33.96 | 1 | 5 | 1 | 43 | 387.507 | 6 | ↓ |