In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 33 | 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) | 3.67 | 5.54 | -16.2 | 3 | 8 | 0 | 108 | 471.941 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 5.92 | -16.75 | 3 | 8 | 0 | 108 | 471.941 | 9 | ↓ |