In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 39 | 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) | 5.45 | 16.5 | -69.18 | 1 | 11 | 0 | 157 | 538.601 | 15 | ↓ |
Lo Low (pH 4.5-6) | 5.45 | 15.75 | -61.98 | 2 | 11 | 1 | 154 | 539.609 | 15 | ↓ |