In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2011 | 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) | 2.19 | 7.31 | -57.68 | 1 | 4 | -1 | 69 | 248.302 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.19 | 5.35 | -10.17 | 2 | 4 | 0 | 66 | 249.31 | 5 | ↓ |