In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2010 | 42 | 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) | 5.71 | 5.77 | -22.58 | 4 | 10 | 0 | 160 | 566.518 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.71 | 6.76 | -68.6 | 3 | 10 | -1 | 163 | 565.51 | 5 | ↓ |