In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 33 | 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) | 5.61 | 11.72 | -7.41 | 1 | 5 | 0 | 53 | 455.687 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.61 | 13.92 | -49.47 | 2 | 5 | 1 | 54 | 456.695 | 11 | ↓ |