In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2009 | 35 | 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) | 4.07 | 12.51 | -72.36 | 1 | 7 | 0 | 77 | 479.621 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.07 | 10.2 | -61 | 0 | 7 | -1 | 76 | 478.613 | 11 | ↓ |