In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 34 | 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) | 4.25 | 13.02 | -46.57 | 1 | 7 | 1 | 73 | 498.39 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 12.51 | -13.45 | 0 | 7 | 0 | 71 | 497.382 | 7 | ↓ |