In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2006 | 27 | 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) | 2.54 | 5.22 | -61.92 | 1 | 6 | -1 | 90 | 386.811 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.98 | -1.85 | -21.35 | 2 | 6 | 0 | 87 | 387.819 | 5 | ↓ |