In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2010 | 16 | 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) | 0.74 | 3.62 | -42.15 | 1 | 5 | 1 | 45 | 250.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 1.71 | -7.59 | 0 | 5 | 0 | 44 | 249.38 | 4 | ↓ |