In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 14 | 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) | 3.31 | 5.43 | -40.02 | 0 | 2 | -1 | 40 | 230.07 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 8.12 | -14.27 | 0 | 2 | 0 | 34 | 231.078 | 3 | ↓ |