In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 18 | 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) | 1.79 | 3.75 | -46.82 | 3 | 3 | 1 | 40 | 269.796 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.79 | 5.72 | -106.34 | 4 | 3 | 2 | 41 | 270.804 | 5 | ↓ |