In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 34 | 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) | -0.60 | 5.93 | -55.01 | 6 | 11 | 0 | 173 | 488.57 | 11 | ↓ |
Hi High (pH 8-9.5) | -0.60 | 5.58 | -57.8 | 5 | 11 | -1 | 171 | 487.562 | 11 | ↓ |