In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 40 | No |
None
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) | 2.42 | 7.75 | -122.31 | 8 | 9 | 2 | 133 | 557.78 | 22 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 9.13 | -201.32 | 9 | 9 | 3 | 137 | 558.788 | 22 | ↓ |