In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 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) | 3.19 | 6.77 | -55.46 | 1 | 11 | 1 | 132 | 501.541 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.19 | 4.55 | -21.57 | 0 | 11 | 0 | 131 | 500.533 | 6 | ↓ |