In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2009 | 34 | No |
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) | 0.37 | 7.45 | -20.68 | 0 | 11 | 0 | 117 | 470.53 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.37 | 9.72 | -55.48 | 1 | 11 | 1 | 118 | 471.538 | 6 | ↓ |