In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2008 | 32 | 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) | 2.35 | 6.32 | -57.81 | 0 | 8 | -1 | 107 | 477.946 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 5.48 | -16.75 | 1 | 8 | 0 | 104 | 478.954 | 7 | ↓ |