In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 35 | 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) | 3.81 | 8.73 | -57.91 | 0 | 8 | -1 | 107 | 497.593 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 8.02 | -16.07 | 1 | 8 | 0 | 104 | 498.601 | 11 | ↓ |