In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 33 | 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) | 4.42 | 10.82 | -8.67 | 0 | 4 | 0 | 33 | 470.482 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.42 | 13.22 | -40.56 | 1 | 4 | 1 | 34 | 471.49 | 8 | ↓ |