In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 15 | Yes |
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) | 0.80 | 6.02 | -44.36 | 1 | 4 | 1 | 38 | 209.269 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 4.01 | -8.43 | 0 | 4 | 0 | 37 | 208.261 | 1 | ↓ |