In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 14th, 2008 | 13 | 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) | 0.86 | 7.31 | -43.25 | 1 | 3 | 1 | 22 | 182.291 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 7.78 | -89.29 | 2 | 3 | 2 | 24 | 183.299 | 5 | ↓ |