In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 31 | 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) | 4.77 | 11.99 | -60.83 | 1 | 5 | 0 | 65 | 479.791 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.77 | 11.23 | -47.92 | 2 | 5 | 1 | 62 | 480.799 | 6 | ↓ |