In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2004 | 36 | Yes |
Popular Name: [2-hydroxy-4-[(2R)-2-hydroxy-3-(4-salicyloylphenoxy)propoxy]phenyl]-phenyl-methanone [2-hydroxy-4-[(2R)-2-hydroxy-3-(…
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) | 5.80 | 7.85 | -26.63 | 3 | 7 | 0 | 113 | 484.504 | 10 | ↓ |
Hi High (pH 8-9.5) | 5.80 | 9.68 | -111.86 | 1 | 7 | -2 | 119 | 482.488 | 10 | ↓ |
Hi High (pH 8-9.5) | 5.80 | 8.65 | -64.45 | 2 | 7 | -1 | 116 | 483.496 | 10 | ↓ |