In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 35 | 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) | 6.77 | 10.25 | -7.29 | 1 | 5 | 0 | 47 | 500.904 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.77 | 12.31 | -34.68 | 2 | 5 | 1 | 48 | 501.912 | 5 | ↓ |