In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | 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) | 3.67 | 5.61 | -46.02 | 3 | 2 | 1 | 37 | 240.754 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 6.38 | -60.16 | 2 | 2 | 0 | 40 | 239.746 | 4 | ↓ |