In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | 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) | 0.77 | 1.58 | -9.9 | 4 | 6 | 0 | 94 | 276.34 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 2.06 | -35.25 | 5 | 6 | 1 | 96 | 277.348 | 2 | ↓ |