In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 30 | No |
Popular Name: (5S)-4-(4-fluorobenzoyl)-3-hydroxy-5-phenyl-1-(2-piperazin-1-ylethyl)-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) | 1.87 | 6.42 | -80.24 | 2 | 6 | 0 | 80 | 409.461 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 5.6 | -51.61 | 3 | 6 | 1 | 77 | 410.469 | 6 | ↓ |