In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 35 | 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) | 5.78 | 13.87 | -41.56 | 1 | 8 | 1 | 87 | 489.474 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.78 | 12.77 | -22.54 | 0 | 8 | 0 | 85 | 488.466 | 9 | ↓ |