In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2006 | 30 | No |
Popular Name: 5-(3-butoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(4-pyridylcarbonyl)-5H-pyrrol-2-one 5-(3-butoxyphenyl)-3-hydroxy-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) | 2.54 | 8.6 | -51.13 | 0 | 7 | -1 | 92 | 409.462 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 7.62 | -19.83 | 0 | 7 | 0 | 86 | 410.47 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 6.62 | -28.59 | 1 | 7 | 0 | 89 | 410.47 | 9 | ↓ |