In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 29 | No |
Popular Name: 4-(4-fluorobenzoyl)-3-hydroxy-5-(p-tolyl)-1-(tetrahydrofuran-2-ylmethyl)-5H-pyrrol-2-one 4-(4-fluorobenzoyl)-3-hydroxy-5-…
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) | 3.36 | 9.65 | -56.79 | 0 | 5 | -1 | 70 | 394.422 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.81 | -0.13 | -25.28 | 1 | 5 | 0 | 66 | 395.43 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 0.09 | -14.77 | 0 | 5 | 0 | 63 | 395.43 | 5 | ↓ |