In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 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) | 0.32 | -0.03 | -47.75 | 4 | 4 | 1 | 66 | 212.269 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.32 | -0.43 | -8.78 | 3 | 4 | 0 | 65 | 211.261 | 7 | ↓ |