In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 39 | 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) | 5.64 | 12.92 | -62.79 | 0 | 7 | -1 | 88 | 528.625 | 13 | ↓ |
Mid Mid (pH 6-8) | 6.09 | 11.83 | -30.67 | 1 | 7 | 0 | 85 | 529.633 | 12 | ↓ |