In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 11 | Yes |
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) | -0.06 | 1.04 | -103.37 | 5 | 3 | 2 | 52 | 162.277 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.06 | 0.45 | -30.48 | 4 | 3 | 1 | 51 | 161.269 | 6 | ↓ |