In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 49 | 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) | 4.26 | 9.67 | -61.89 | 7 | 11 | 1 | 168 | 671.863 | 13 | ↓ |
Hi High (pH 8-9.5) | 4.26 | 7.63 | -25.02 | 6 | 11 | 0 | 167 | 670.855 | 13 | ↓ |