In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 31 | 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) | 4.92 | 13.32 | -38.37 | 2 | 4 | 1 | 29 | 472.984 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.92 | 11.61 | -8.83 | 1 | 4 | 0 | 28 | 471.976 | 8 | ↓ |