In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 15 | 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) | 0.15 | -0.06 | -47.88 | 5 | 4 | 1 | 77 | 209.269 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.15 | -0.4 | -9.82 | 4 | 4 | 0 | 75 | 208.261 | 4 | ↓ |