In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 34 | Yes |
Popular Name: benzyl-[[3-(4-carbethoxyphenoxy)-7-hydroxy-4-keto-chromen-8-yl]methyl]-methyl-ammonium benzyl-[[3-(4-carbethoxyphenoxy)…
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) | 5.14 | 12.9 | -62.74 | 2 | 7 | 1 | 90 | 460.506 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.14 | 13.53 | -35.94 | 1 | 7 | 0 | 93 | 459.498 | 9 | ↓ |