In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 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) | 5.44 | 12.45 | -67.62 | 0 | 6 | -1 | 83 | 469.542 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.89 | 12.78 | -25.71 | 1 | 6 | 0 | 80 | 470.55 | 4 | ↓ |