In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 24 | 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) | 4.57 | 11.73 | -39.96 | 1 | 4 | 1 | 40 | 352.882 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.57 | 9.41 | -6.37 | 0 | 4 | 0 | 39 | 351.874 | 7 | ↓ |