In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 32 | 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) | 5.50 | 14.16 | -10.55 | 0 | 5 | 0 | 49 | 469.416 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.50 | 14.48 | -35.06 | 1 | 5 | 1 | 51 | 470.424 | 4 | ↓ |