In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2010 | 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) | -2.79 | -9.08 | -16.72 | 8 | 11 | 0 | 191 | 449.388 | 4 | ↓ |
Hi High (pH 8-9.5) | -2.79 | -8.32 | -29.83 | 7 | 11 | 0 | 194 | 448.38 | 4 | ↓ |