In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2006 | 25 | No |
Popular Name: 1-allyl-4-benzoyl-5-(3-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 1-allyl-4-benzoyl-5-(3-fluorophe…
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) | 3.16 | 8.72 | -55.51 | 0 | 4 | -1 | 60 | 336.342 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 8.52 | -14.1 | 1 | 4 | 0 | 58 | 337.35 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 9.83 | -17.98 | 0 | 4 | 0 | 54 | 337.35 | 5 | ↓ |