In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2009 | 34 | No |
None
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) | 5.62 | 11.56 | -58.13 | 1 | 4 | -1 | 77 | 469.686 | 1 | ↓ |
Lo Low (pH 4.5-6) | 5.62 | 9.58 | -13.15 | 2 | 4 | 0 | 75 | 470.694 | 1 | ↓ |