In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 28 | Yes |
Popular Name: 1-[(E)-cinnamyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine 1-[(E)-cinnamyl]-4-[4-(trifluoro…
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) | 4.39 | 8.03 | -9.33 | 0 | 4 | 0 | 41 | 410.461 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.39 | 10.3 | -52.2 | 1 | 4 | 1 | 42 | 411.469 | 6 | ↓ |