| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 33 | Yes |
Popular Name: benzyl-ethyl-[[7-hydroxy-4-keto-3-phenyl-2-(trifluoromethyl)chromen-8-yl]methyl]ammonium benzyl-ethyl-[[7-hydroxy-4-keto-…
| 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) | 6.15 | 12.91 | -45 | 2 | 4 | 1 | 55 | 454.468 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.15 | 13.48 | -25.36 | 1 | 4 | 0 | 58 | 453.46 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.15 | 10.45 | -7.59 | 1 | 4 | 0 | 54 | 453.46 | 7 | ↓ |
