In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 19 | 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) | 2.96 | 3.53 | -11.99 | 1 | 4 | 0 | 56 | 258.273 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 4.32 | -45.54 | 0 | 4 | -1 | 59 | 257.265 | 4 | ↓ |