| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 27 | Yes |
Popular Name: (2E,4E,6E)-3-methyl-7-pyren-1-yl-octa-2,4,6-trienoic (2E,4E,6E)-3-methyl-7-pyren-1-yl…
| 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) | 6.27 | 14.04 | -57.55 | 0 | 2 | -1 | 40 | 351.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 6.27 | 13.46 | -11.17 | 1 | 2 | 0 | 37 | 352.433 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
