In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 25 | Yes |
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) | 5.51 | 13.89 | -54.73 | 0 | 3 | -1 | 57 | 337.439 | 11 | ↓ |
Lo Low (pH 4.5-6) | 5.51 | 12.77 | -16.18 | 1 | 3 | 0 | 54 | 338.447 | 11 | ↓ |