In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 35 | 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) | 5.32 | 12.67 | -56.12 | 0 | 6 | -1 | 77 | 486.548 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.32 | 11.94 | -13.43 | 1 | 6 | 0 | 74 | 487.556 | 5 | ↓ |