In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2006 | 28 | Yes |
None
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) | 3.96 | 11.01 | -13.07 | 2 | 7 | 0 | 85 | 374.448 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.14 | 11.3 | -33.09 | 3 | 7 | 1 | 90 | 375.456 | 3 | ↓ |