In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 32 | 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) | 5.89 | 13.38 | -37.35 | 0 | 4 | -1 | 60 | 465.356 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.89 | 12.25 | -14.76 | 1 | 4 | 0 | 58 | 466.364 | 5 | ↓ |