In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2008 | 22 | 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) | 1.62 | 5.11 | -55.32 | 0 | 6 | -1 | 90 | 319.362 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.62 | 5.39 | -72.26 | 1 | 6 | 0 | 92 | 320.37 | 6 | ↓ |