In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | 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) | 1.69 | 6.4 | -11.5 | 2 | 4 | 0 | 56 | 224.267 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 6.81 | -28.05 | 3 | 4 | 1 | 57 | 225.275 | 1 | ↓ |