In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2009 | 24 | 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) | -4.85 | -2.54 | -62.98 | 5 | 11 | 1 | 149 | 339.332 | 4 | ↓ |
Hi High (pH 8-9.5) | -4.64 | -3.83 | -57.16 | 4 | 11 | 0 | 152 | 338.324 | 4 | ↓ |