In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2008 | 18 | No |
Popular Name: (4R)-4-[(E)-2-hydroxyethyliminomethyl]-5-methyl-2-phenyl-4H-pyrazol-3-one (4R)-4-[(E)-2-hydroxyethyliminom…
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) | 0.40 | 2.57 | -21.24 | 2 | 5 | 0 | 67 | 245.282 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.92 | -0.13 | -11.02 | 2 | 5 | 0 | 71 | 245.282 | 4 | ↓ |