In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2009 | 44 | 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) | 6.07 | 12.53 | -61.71 | 1 | 7 | -1 | 116 | 633.856 | 7 | ↓ |
Lo Low (pH 4.5-6) | 6.07 | 12.28 | -26.46 | 2 | 7 | 0 | 113 | 634.864 | 7 | ↓ |