In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 25 | No |
Popular Name: (5S)-4-(4-fluorobenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-5-phenyl-5H-pyrrol-2-one (5S)-4-(4-fluorobenzoyl)-3-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) | 1.91 | 5.29 | -60.36 | 1 | 5 | -1 | 81 | 340.33 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 4.26 | -24.78 | 2 | 5 | 0 | 78 | 341.338 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.33 | 5.25 | -17.53 | 1 | 5 | 0 | 75 | 341.338 | 5 | ↓ |