In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 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) | 1.71 | 1.06 | -18.9 | 4 | 11 | 0 | 165 | 474.418 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.71 | 2.04 | -65.69 | 3 | 11 | -1 | 168 | 473.41 | 6 | ↓ |