In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 31 | 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) | 5.98 | 10.36 | -6.91 | 1 | 4 | 0 | 37 | 434.898 | 3 | ↓ |
Mid Mid (pH 6-8) | 5.98 | 12.46 | -40.17 | 2 | 4 | 1 | 39 | 435.906 | 3 | ↓ |