In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 28 | No |
Popular Name: (5S)-4-benzoyl-5-(4-fluorophenyl)-3-hydroxy-1-[2-(2-hydroxyethylamino)ethyl]-5H-pyrrol-2-one (5S)-4-benzoyl-5-(4-fluorophenyl…
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) | 1.34 | 5.37 | -75.96 | 3 | 6 | 0 | 97 | 384.407 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.34 | 3.89 | -58.85 | 2 | 6 | -1 | 93 | 383.399 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.34 | 4.54 | -57.82 | 4 | 6 | 1 | 94 | 385.415 | 8 | ↓ |