In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | 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) | 1.86 | 8.77 | -50.02 | 1 | 4 | 1 | 40 | 278.372 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 6.49 | -9.64 | 0 | 4 | 0 | 39 | 277.364 | 7 | ↓ |