In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 35 | 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) | 5.78 | 15.87 | -65.46 | 2 | 5 | 0 | 74 | 477.645 | 11 | ↓ |
Lo Low (pH 4.5-6) | 5.78 | 13.9 | -39.82 | 3 | 5 | 1 | 71 | 478.653 | 11 | ↓ |