In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 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) | 2.41 | 6.61 | -60.6 | 0 | 8 | -1 | 85 | 464.542 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.95 | -74.54 | 1 | 8 | 0 | 87 | 465.55 | 8 | ↓ |