In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 43 | 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) | 6.15 | 13.04 | -20.39 | 1 | 8 | 0 | 91 | 574.681 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.15 | 13.83 | -34.88 | 2 | 8 | 1 | 93 | 575.689 | 9 | ↓ |