In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 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) | 0.74 | 2.92 | -46.51 | 4 | 4 | 1 | 60 | 226.275 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.74 | 0.39 | -10.71 | 3 | 4 | 0 | 58 | 225.267 | 4 | ↓ |