In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 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) | 5.03 | 12.62 | -24.47 | 1 | 8 | 0 | 94 | 516.623 | 10 | ↓ |
Hi High (pH 8-9.5) | 5.21 | 11.39 | -49.76 | 0 | 8 | -1 | 100 | 515.615 | 10 | ↓ |