In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 34 | 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) | 2.47 | 11.63 | -29.57 | 1 | 8 | 0 | 91 | 459.55 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 11.75 | -51.47 | 2 | 8 | 1 | 92 | 460.558 | 8 | ↓ |