In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 25 | 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) | 5.09 | 13.32 | -37.15 | 1 | 4 | 1 | 35 | 414.407 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.09 | 11.3 | -6.97 | 0 | 4 | 0 | 34 | 413.399 | 6 | ↓ |