In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 32 | No |
Popular Name: (2R)-1-butyl-3-(4-ethoxy-3-methyl-benzoyl)-4-hydroxy-2-(4-nitrophenyl)-2H-pyrrol-5-one (2R)-1-butyl-3-(4-ethoxy-3-methy…
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) | 4.58 | 11.65 | -55.35 | 0 | 8 | -1 | 115 | 437.472 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | 10.89 | -16.73 | 1 | 8 | 0 | 113 | 438.48 | 9 | ↓ |