In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 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) | 5.35 | 10.44 | -13.58 | 3 | 8 | 0 | 116 | 471.513 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.35 | 11.4 | -58.55 | 2 | 8 | -1 | 119 | 470.505 | 5 | ↓ |