In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 34 | 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) | 1.23 | 7.2 | -63.09 | 3 | 9 | 1 | 102 | 470.642 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 7.33 | -103.1 | 4 | 9 | 2 | 103 | 471.65 | 6 | ↓ |