In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 11 | 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) | -4.90 | -3.12 | -61.97 | 3 | 6 | -1 | 125 | 200.217 | 4 | ↓ |
Hi High (pH 8-9.5) | -4.90 | -3.44 | -94.87 | 2 | 6 | -2 | 123 | 199.209 | 4 | ↓ |