In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 30 | No |
Popular Name: (2R)-3-(3-butoxybenzoyl)-4-hydroxy-1-(2-hydroxyethyl)-2-(4-hydroxyphenyl)-2H-pyrrol-5-one (2R)-3-(3-butoxybenzoyl)-4-hydro…
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) | 2.74 | 4.28 | -62.83 | 2 | 7 | -1 | 110 | 410.446 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.74 | 3.53 | -16.33 | 3 | 7 | 0 | 107 | 411.454 | 9 | ↓ |