In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 33 | No |
Popular Name: 3-hydroxy-5-phenyl-4-(3-phenylprop-2-enoyl)-1-[3-(trifluoromethyl)phenyl]-5H-pyrrol-2-one 3-hydroxy-5-phenyl-4-(3-phenylpr…
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) | 5.32 | 13.65 | -63.98 | 0 | 4 | -1 | 60 | 448.42 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.32 | 13.04 | -24.9 | 1 | 4 | 0 | 58 | 449.428 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.74 | 3.49 | -25.92 | 0 | 4 | 0 | 54 | 449.428 | 6 | ↓ |