In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 35 | 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) | 6.07 | 14.92 | -35.25 | 2 | 4 | 1 | 45 | 471.665 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.07 | 12.72 | -9.2 | 1 | 4 | 0 | 44 | 470.657 | 8 | ↓ |