In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 33 | No |
Popular Name: 4-(4-allyloxybenzoyl)-1-(2-diethylaminoethyl)-3-hydroxy-5-(4-hydroxyphenyl)-5H-pyrrol-2-one 4-(4-allyloxybenzoyl)-1-(2-dieth…
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) | 3.38 | 8.57 | -52.78 | 3 | 7 | 1 | 92 | 451.543 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 9.25 | -62.5 | 2 | 7 | 1 | 88 | 451.543 | 11 | ↓ |