In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 13 | No |
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) | 0.66 | 4.17 | -4.73 | 4 | 4 | 0 | 71 | 179.223 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 4.07 | -27.92 | 5 | 4 | 1 | 70 | 180.231 | 3 | ↓ |