In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 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) | -1.97 | -1.13 | -26.88 | 4 | 12 | 0 | 157 | 468.47 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.79 | -2.92 | -56.51 | 3 | 12 | -1 | 163 | 467.462 | 2 | ↓ |