In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 19th, 2006 | 22 | No |
Popular Name: 4-acetyl-1-[2-(dimethylamino)ethyl]-5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 4-acetyl-1-[2-(dimethylamino)eth…
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) | 0.97 | 1.95 | -53.17 | 2 | 5 | 1 | 62 | 307.345 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 1.54 | -58.8 | 2 | 5 | 1 | 62 | 307.345 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.39 | 1.72 | -68.01 | 1 | 5 | 1 | 58 | 307.345 | 5 | ↓ |