In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 11 | 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) | -0.87 | 0.83 | -218.65 | 0 | 6 | -3 | 113 | 177.028 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.87 | -0.32 | -110.56 | 1 | 6 | -2 | 110 | 178.036 | 3 | ↓ |