In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 34 | 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) | 2.07 | 6.78 | -34.76 | 4 | 13 | 1 | 160 | 470.514 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 4.57 | -13.97 | 3 | 13 | 0 | 159 | 469.506 | 8 | ↓ |