In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 30 | No |
Popular Name: 5-(4-allyloxyphenyl)-4-(4-chlorobenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one 5-(4-allyloxyphenyl)-4-(4-chloro…
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) | 3.74 | 9.37 | -38.19 | 0 | 6 | -1 | 79 | 426.876 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 0.03 | -17.09 | 0 | 6 | 0 | 72 | 427.884 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 7.83 | -25.33 | 1 | 6 | 0 | 76 | 427.884 | 8 | ↓ |