In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 39 | 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) | 5.92 | 13.7 | -44.29 | 0 | 7 | -1 | 88 | 528.625 | 12 | ↓ |
Mid Mid (pH 6-8) | 5.34 | 1.33 | -20.58 | 0 | 7 | 0 | 82 | 529.633 | 12 | ↓ |