In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2006 | 28 | 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) | 3.66 | 10.6 | -18.67 | 1 | 7 | 0 | 76 | 398.85 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 11.36 | -89.91 | 2 | 7 | 0 | 77 | 399.858 | 7 | ↓ |