In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2006 | 22 | No |
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) | 0.42 | 1.31 | -45.16 | 3 | 7 | -1 | 102 | 339.784 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 2.38 | -13.1 | 4 | 7 | 0 | 99 | 340.792 | 5 | ↓ |