In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 22 | No |
Popular Name: (5S)-4-acetyl-3-hydroxy-1-[2-(2-hydroxyethylamino)ethyl]-5-(3-pyridyl)-5H-pyrrol-2-one (5S)-4-acetyl-3-hydroxy-1-[2-(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) | -1.66 | 1.5 | -77.12 | 3 | 7 | 0 | 110 | 305.334 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.66 | 0.01 | -60.55 | 2 | 7 | -1 | 106 | 304.326 | 7 | ↓ |