In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 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) | 2.68 | 4.32 | -95.75 | 4 | 5 | 2 | 71 | 270.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 4.08 | -36.89 | 3 | 5 | 1 | 69 | 269.413 | 8 | ↓ |