In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 23 | 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) | 0.52 | 6.02 | -358.17 | 0 | 10 | -4 | 171 | 390.158 | 10 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 4.88 | -220.96 | 1 | 10 | -3 | 168 | 391.166 | 10 | ↓ |