In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 38 | No |
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) | 3.06 | 11.23 | -92.18 | 4 | 9 | 2 | 97 | 529.726 | 11 | ↓ |
Hi High (pH 8-9.5) | 3.24 | 8.52 | -53.84 | 3 | 9 | 1 | 103 | 528.718 | 11 | ↓ |