In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 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) | 4.34 | 10.43 | -40.07 | 0 | 7 | -1 | 88 | 486.972 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.79 | 8.89 | -30.75 | 1 | 7 | 0 | 85 | 487.98 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 9.89 | -24.7 | 0 | 7 | 0 | 82 | 487.98 | 11 | ↓ |