In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 20 | 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) | 1.51 | 3.45 | -57.46 | 1 | 6 | -1 | 110 | 295.34 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.51 | 2.33 | -18.19 | 2 | 6 | 0 | 107 | 296.348 | 8 | ↓ |