In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2008 | 30 | 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) | -0.57 | -6.94 | -71.06 | 3 | 11 | -1 | 159 | 452.494 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.57 | -6.84 | -75.59 | 4 | 11 | 0 | 161 | 453.502 | 6 | ↓ |