In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2008 | 26 | 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) | 3.99 | 8.22 | -11.16 | 3 | 5 | 0 | 77 | 385.876 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.99 | 8.45 | -37.16 | 4 | 5 | 1 | 78 | 386.884 | 4 | ↓ |