In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2008 | 15 | 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) | 1.75 | 2.98 | -6.92 | 3 | 4 | 0 | 68 | 208.261 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | 3.02 | -31.41 | 4 | 4 | 1 | 69 | 209.269 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | 2.93 | -33.83 | 4 | 4 | 1 | 69 | 209.269 | 5 | ↓ |