In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 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) | 4.20 | 10.69 | -55.37 | 3 | 8 | 1 | 101 | 531.629 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 11.39 | -64.38 | 2 | 8 | 1 | 98 | 531.629 | 11 | ↓ |