In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 35 | 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) | 5.32 | 12.6 | -13.32 | 1 | 5 | 0 | 51 | 472.629 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.32 | 14.42 | -43.15 | 2 | 5 | 1 | 52 | 473.637 | 10 | ↓ |