In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 37 | 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) | 1.03 | 9.17 | -51.33 | 3 | 10 | 1 | 104 | 513.663 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.03 | 11.43 | -125.75 | 4 | 10 | 2 | 105 | 514.671 | 6 | ↓ |