In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 37 | Yes |
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) | 6.77 | 16.32 | -40.73 | 1 | 5 | 1 | 51 | 517.625 | 8 | ↓ |
Hi High (pH 8-9.5) | 6.77 | 13.9 | -9.03 | 0 | 5 | 0 | 49 | 516.617 | 8 | ↓ |