In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 34 | No |
Popular Name: (5R)-4-benzoyl-1-(2-diethylaminoethyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-5H-pyrrol-2-one (5R)-4-benzoyl-1-(2-diethylamino…
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) | 2.79 | 10.62 | -72.6 | 1 | 8 | 0 | 93 | 468.55 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 8.42 | -58.88 | 0 | 8 | -1 | 91 | 467.542 | 11 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 9.8 | -56.34 | 2 | 8 | 1 | 90 | 469.558 | 11 | ↓ |