In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2008 | 21 | 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) | 5.74 | 11.34 | -9.05 | 0 | 1 | 0 | 13 | 269.347 | 1 | ↓ |
Lo Low (pH 4.5-6) | 5.74 | 11.54 | -26.82 | 1 | 1 | 1 | 14 | 270.355 | 1 | ↓ |