In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | 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) | 2.10 | 8.67 | -46.2 | 3 | 2 | 1 | 37 | 270.396 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.10 | 8.37 | -3.96 | 2 | 2 | 0 | 35 | 269.388 | 7 | ↓ |