In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 23rd, 2009 | 16 | 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) | 0.52 | 3.38 | -90.5 | 5 | 4 | 2 | 61 | 229.368 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 3.09 | -37.94 | 4 | 4 | 1 | 60 | 228.36 | 5 | ↓ |