In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2006 | 30 | No |
Popular Name: N-[2-[3-benzoyl-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]ethyl]acetamide N-[2-[3-benzoyl-4-hydroxy-2-(4-n…
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) | 1.48 | 7.03 | -70.1 | 1 | 9 | -1 | 135 | 408.39 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.93 | -1.96 | -38.87 | 2 | 9 | 0 | 132 | 409.398 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.90 | -1.71 | -38.31 | 1 | 9 | 0 | 129 | 409.398 | 7 | ↓ |