In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2006 | 27 | No |
Popular Name: 5-(4-ethylphenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(4-pyridylcarbonyl)-5H-pyrrol-2-one 5-(4-ethylphenyl)-3-hydroxy-1-(2…
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) | 1.99 | 8.03 | -55.38 | 0 | 6 | -1 | 83 | 365.409 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.43 | -0.82 | -24.72 | 1 | 6 | 0 | 79 | 366.417 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.40 | -0.52 | -18.73 | 0 | 6 | 0 | 76 | 366.417 | 7 | ↓ |