In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 34 | 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) | 3.85 | 9.73 | -61.91 | 0 | 7 | -1 | 88 | 464.538 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 8.91 | -16.61 | 1 | 7 | 0 | 85 | 465.546 | 8 | ↓ |