In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2010 | 32 | No |
None
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) | 0.01 | -6.43 | -16.25 | 7 | 11 | 0 | 186 | 450.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.01 | -5.44 | -57.45 | 6 | 11 | -1 | 189 | 449.388 | 3 | ↓ |