In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2007 | 31 | No |
Popular Name: 4-(3-chloro-4-ethoxy-benzoyl)-1-(2-furylmethyl)-3-hydroxy-5-phenyl-5H-pyrrol-2-one 4-(3-chloro-4-ethoxy-benzoyl)-1-…
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) | 4.07 | 10.54 | -37.06 | 0 | 6 | -1 | 83 | 436.871 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 0.4 | -28.71 | 1 | 6 | 0 | 79 | 437.879 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 0.67 | -24.95 | 0 | 6 | 0 | 76 | 437.879 | 7 | ↓ |