In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 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) | 5.28 | 11.75 | -16.31 | 1 | 8 | 0 | 95 | 537.653 | 14 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 12.45 | -22.35 | 0 | 8 | 0 | 91 | 537.653 | 14 | ↓ |