In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 26 | 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) | 4.80 | 9.66 | -44.22 | 1 | 4 | 1 | 34 | 466.755 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 7.52 | -9.06 | 0 | 4 | 0 | 33 | 465.747 | 3 | ↓ |